Benzodioxoles

Aromatic organic heterocyclic compounds that consist of a benzene containing the methylenedioxy functional group; methylenedioxy functional groups have two oxygen atoms connected to a methylene bridge.

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Berberine chloride

CAS: 633-65-8 Molecular Formula: C20H18ClNO4 Molecular Weight (g/mol): 371.817 MDL Number: MFCD00011939 InChI Key: VKJGBAJNNALVAV-UHFFFAOYSA-M Synonym: berberine chloride,berberine hydrochloride,natural yellow 18,benzodioxide,berberinium chloride,berberine hcl,unii-uot4o1byv8,berberine chloride jan,uot4o1byv8 PubChem CID: 12456 ChEBI: CHEBI:31271 SMILES: COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.[Cl-]

Pricing and Availability
Specifications

PubChem CID	12456
CAS	633-65-8
Molecular Weight (g/mol)	371.817
ChEBI	CHEBI:31271
MDL Number	MFCD00011939
SMILES	COC1=C(C2=C[N+]3=C(C=C2C=C1)C4=CC5=C(C=C4CC3)OCO5)OC.[Cl-]
Synonym	berberine chloride,berberine hydrochloride,natural yellow 18,benzodioxide,berberinium chloride,berberine hcl,unii-uot4o1byv8,berberine chloride jan,uot4o1byv8
InChI Key	VKJGBAJNNALVAV-UHFFFAOYSA-M
Molecular Formula	C20H18ClNO4

2,2-Difluoro-1,3-benzodioxole, 97%

CAS: 1583-59-1 Molecular Formula: C7H4F2O2 Molecular Weight (g/mol): 158.10 MDL Number: MFCD00236217 InChI Key: DGCOGZQDAXUUBY-UHFFFAOYSA-N Synonym: 2,2-difluorobenzo d 1,3 dioxole,2,2-difluorobenzodioxole,2,2-difluoro-2h-1,3-benzodioxole,1,2-difluoromethylenedioxy benzene,2,2-difluoro-benzodioxole,2,2-difluoro-benzo 1,3 dioxole,1,3-benzodioxole, 2,2-difluoro,pubchem17570,acmc-1bus1,ksc491c9d PubChem CID: 74103 IUPAC Name: 2,2-difluoro-2H-1,3-benzodioxole SMILES: FC1(F)OC2=CC=CC=C2O1

Pricing and Availability
Specifications

PubChem CID	74103
CAS	1583-59-1
Molecular Weight (g/mol)	158.10
MDL Number	MFCD00236217
SMILES	FC1(F)OC2=CC=CC=C2O1
Synonym	2,2-difluorobenzo d 1,3 dioxole,2,2-difluorobenzodioxole,2,2-difluoro-2h-1,3-benzodioxole,1,2-difluoromethylenedioxy benzene,2,2-difluoro-benzodioxole,2,2-difluoro-benzo 1,3 dioxole,1,3-benzodioxole, 2,2-difluoro,pubchem17570,acmc-1bus1,ksc491c9d
IUPAC Name	2,2-difluoro-2H-1,3-benzodioxole
InChI Key	DGCOGZQDAXUUBY-UHFFFAOYSA-N
Molecular Formula	C7H4F2O2

2,2-Difluoro-1,3-benzodioxole-4-carboxylic acid, 97%

CAS: 126120-85-2 Molecular Formula: C8H4F2O4 Molecular Weight (g/mol): 202.113 MDL Number: MFCD01631473 InChI Key: ZGAQVJDFFVTWJK-UHFFFAOYSA-N Synonym: 2,2-difluorobenzo d 1,3 dioxole-4-carboxylic acid,2,2-difluoro-2h-1,3-benzodioxole-4-carboxylic acid,2,2-difluoro-1,3-benzodioxole-4-carboxylicacid,2,2-difluoro-benzo 1,3 dioxole-4-carboxylic acid,2,2-difluorobenzo d 1,3-dioxolene-4-carboxylic acid,acmc-1c3im,1,3-benzodioxole-4-carboxylicacid, 2,2-difluoro,2,2-bis fluoranyl-1,3-benzodioxole-4-carboxylic acid,2,2-difluoro-1,3-benzodioxole-4-carboxylic acid PubChem CID: 2774067 IUPAC Name: 2,2-difluoro-1,3-benzodioxole-4-carboxylic acid SMILES: C1=CC(=C2C(=C1)OC(O2)(F)F)C(=O)O

Pricing and Availability
Specifications

PubChem CID	2774067
CAS	126120-85-2
Molecular Weight (g/mol)	202.113
MDL Number	MFCD01631473
SMILES	C1=CC(=C2C(=C1)OC(O2)(F)F)C(=O)O
Synonym	2,2-difluorobenzo d 1,3 dioxole-4-carboxylic acid,2,2-difluoro-2h-1,3-benzodioxole-4-carboxylic acid,2,2-difluoro-1,3-benzodioxole-4-carboxylicacid,2,2-difluoro-benzo 1,3 dioxole-4-carboxylic acid,2,2-difluorobenzo d 1,3-dioxolene-4-carboxylic acid,acmc-1c3im,1,3-benzodioxole-4-carboxylicacid, 2,2-difluoro,2,2-bis fluoranyl-1,3-benzodioxole-4-carboxylic acid,2,2-difluoro-1,3-benzodioxole-4-carboxylic acid
IUPAC Name	2,2-difluoro-1,3-benzodioxole-4-carboxylic acid
InChI Key	ZGAQVJDFFVTWJK-UHFFFAOYSA-N
Molecular Formula	C8H4F2O4

6-Bromopiperonal, 98%

CAS: 15930-53-7 Molecular Formula: C8H5BrO3 Molecular Weight (g/mol): 229.03 MDL Number: MFCD00022952 InChI Key: CSQUXTSIDQURDV-UHFFFAOYSA-N Synonym: 6-bromopiperonal,6-bromo-benzo 1,3 dioxole-5-carbaldehyde,2-bromo-4,5-methylenedioxybenzaldehyde,piperonal, 6-bromo,6-bromobenzo d 1,3 dioxole-5-carbaldehyde,6-bromo-1,3-benzodioxole-5-carboxaldehyde,6-bromo-2h-1,3-benzodioxole-5-carbaldehyde,1,3-benzodioxole-5-carboxaldehyde, 6-bromo,6-bromobenzo 1,3 dioxole-5-carbaldehyde,benzaldehyde, 2-bromo-4,5-methylenedioxy PubChem CID: 95062 SMILES: BrC1=CC2=C(OCO2)C=C1C=O

Pricing and Availability
Specifications

PubChem CID	95062
CAS	15930-53-7
Molecular Weight (g/mol)	229.03
MDL Number	MFCD00022952
SMILES	BrC1=CC2=C(OCO2)C=C1C=O
Synonym	6-bromopiperonal,6-bromo-benzo 1,3 dioxole-5-carbaldehyde,2-bromo-4,5-methylenedioxybenzaldehyde,piperonal, 6-bromo,6-bromobenzo d 1,3 dioxole-5-carbaldehyde,6-bromo-1,3-benzodioxole-5-carboxaldehyde,6-bromo-2h-1,3-benzodioxole-5-carbaldehyde,1,3-benzodioxole-5-carboxaldehyde, 6-bromo,6-bromobenzo 1,3 dioxole-5-carbaldehyde,benzaldehyde, 2-bromo-4,5-methylenedioxy
InChI Key	CSQUXTSIDQURDV-UHFFFAOYSA-N
Molecular Formula	C8H5BrO3

Piperonylic acid, 99%

CAS: 94-53-1 Molecular Formula: C8H6O4 Molecular Weight (g/mol): 166.13 MDL Number: MFCD00005830 InChI Key: VDVJGIYXDVPQLP-UHFFFAOYSA-N Synonym: piperonylic acid,heliotropic acid,3,4-methylenedioxybenzoic acid,benzo d 1,3 dioxole-5-carboxylic acid,2h-1,3-benzodioxole-5-carboxylic acid,benzo 1,3 dioxole-5-carboxylic acid,protocatechuic acid methylene ether,5-benzodioxolecarboxylic acid,3,4-dioxymethylenebenzoic acid,3,4-methylene dioxybenzoic acid PubChem CID: 7196 IUPAC Name: 1,3-benzodioxole-5-carboxylic acid SMILES: OC(=O)C1=CC=C2OCOC2=C1

Pricing and Availability
Specifications

PubChem CID	7196
CAS	94-53-1
Molecular Weight (g/mol)	166.13
MDL Number	MFCD00005830
SMILES	OC(=O)C1=CC=C2OCOC2=C1
Synonym	piperonylic acid,heliotropic acid,3,4-methylenedioxybenzoic acid,benzo d 1,3 dioxole-5-carboxylic acid,2h-1,3-benzodioxole-5-carboxylic acid,benzo 1,3 dioxole-5-carboxylic acid,protocatechuic acid methylene ether,5-benzodioxolecarboxylic acid,3,4-dioxymethylenebenzoic acid,3,4-methylene dioxybenzoic acid
IUPAC Name	1,3-benzodioxole-5-carboxylic acid
InChI Key	VDVJGIYXDVPQLP-UHFFFAOYSA-N
Molecular Formula	C8H6O4

3,4-(Methylenedioxy)aniline, 97%

CAS: 14268-66-7 Molecular Formula: C₇H₇NO₂ Molecular Weight (g/mol): 137.14 MDL Number: MFCD00005832 InChI Key: XGNXYCFREOZBOL-UHFFFAOYSA-N Synonym: 3,4-methylenedioxy aniline,benzo d 1,3 dioxol-5-amine,5-amino-1,3-benzodioxole,3,4-methylenedioxyaniline,4-amino-1,2-methylenedioxybenzene,5-aminobenzodioxole,methylenedioxyaniline,2h-1,3-benzodioxol-5-amine,1-amino-3,4-methylenedioxybenzene,1-amino-3,4-dimethylenedioxybenzene PubChem CID: 84310 IUPAC Name: 1,3-benzodioxol-5-amine SMILES: C1OC2=C(O1)C=C(C=C2)N

Pricing and Availability
Specifications

PubChem CID	84310
CAS	14268-66-7
Molecular Weight (g/mol)	137.14
MDL Number	MFCD00005832
SMILES	C1OC2=C(O1)C=C(C=C2)N
Synonym	3,4-methylenedioxy aniline,benzo d 1,3 dioxol-5-amine,5-amino-1,3-benzodioxole,3,4-methylenedioxyaniline,4-amino-1,2-methylenedioxybenzene,5-aminobenzodioxole,methylenedioxyaniline,2h-1,3-benzodioxol-5-amine,1-amino-3,4-methylenedioxybenzene,1-amino-3,4-dimethylenedioxybenzene
IUPAC Name	1,3-benzodioxol-5-amine
InChI Key	XGNXYCFREOZBOL-UHFFFAOYSA-N
Molecular Formula	C₇H₇NO₂

3,4-(Methylenedioxy)phenylglyoxal hydrate, 97%, dry wt basis

CAS: 65709-23-1 Molecular Formula: C9H6O4 Molecular Weight (g/mol): 178.14 MDL Number: MFCD03411518 InChI Key: OUCBKIWZWGSDJL-UHFFFAOYSA-N Synonym: 3,4-methylenedioxyphenylglyoxal hydrate,2-benzo d 1,3 dioxol-5-yl-2-oxoacetaldehyde hydrate,3,4-methylenedioxy phenylglyoxal hydrate,2-2h-1,3-benzodioxol-5-yl-2-oxoacetaldehyde hydrate,pubchem12143,benzo d 1,3 dioxole-5-glyoxal hydrate,2-1,3-benzodioxol-5-yl-2-oxoacetaldehyde hydrate,2-1,3-benzodioxol-5-yl-2-oxidanylidene-ethanal hydrate,2-2h-benzo 3,4-d 1,3-dioxolan-5-yl-2-oxoethanal, hydrate PubChem CID: 15608490 IUPAC Name: 2-(1,3-benzodioxol-5-yl)-2-oxoacetaldehyde;hydrate SMILES: O=CC(=O)C1=CC2=C(OCO2)C=C1

Pricing and Availability
Specifications

PubChem CID	15608490
CAS	65709-23-1
Molecular Weight (g/mol)	178.14
MDL Number	MFCD03411518
SMILES	O=CC(=O)C1=CC2=C(OCO2)C=C1
Synonym	3,4-methylenedioxyphenylglyoxal hydrate,2-benzo d 1,3 dioxol-5-yl-2-oxoacetaldehyde hydrate,3,4-methylenedioxy phenylglyoxal hydrate,2-2h-1,3-benzodioxol-5-yl-2-oxoacetaldehyde hydrate,pubchem12143,benzo d 1,3 dioxole-5-glyoxal hydrate,2-1,3-benzodioxol-5-yl-2-oxoacetaldehyde hydrate,2-1,3-benzodioxol-5-yl-2-oxidanylidene-ethanal hydrate,2-2h-benzo 3,4-d 1,3-dioxolan-5-yl-2-oxoethanal, hydrate
IUPAC Name	2-(1,3-benzodioxol-5-yl)-2-oxoacetaldehyde;hydrate
InChI Key	OUCBKIWZWGSDJL-UHFFFAOYSA-N
Molecular Formula	C9H6O4

Piperonyl butoxide, 90%, Tech.

CAS: 51-03-6 Molecular Formula: C19H30O5 Molecular Weight (g/mol): 338.44 MDL Number: MFCD00005842 InChI Key: FIPWRIJSWJWJAI-UHFFFAOYSA-N Synonym: piperonyl butoxide,butacide,butocide,ethanol butoxide,pyrenone 606,piperonylbutoxide,6-propylpiperonyl butyl diethylene glycol ether,butyl carbitol 6-propylpiperonyl ether,5-2-2-butoxyethoxy ethoxy methyl-6-propylbenzo d 1,3 dioxole,butoxide synergist PubChem CID: 5794 ChEBI: CHEBI:32687 IUPAC Name: 5-[2-(2-butoxyethoxy)ethoxymethyl]-6-propyl-1,3-benzodioxole SMILES: CCCCOCCOCCOCC1=CC2=C(OCO2)C=C1CCC

Pricing and Availability
Specifications

PubChem CID	5794
CAS	51-03-6
Molecular Weight (g/mol)	338.44
ChEBI	CHEBI:32687
MDL Number	MFCD00005842
SMILES	CCCCOCCOCCOCC1=CC2=C(OCO2)C=C1CCC
Synonym	piperonyl butoxide,butacide,butocide,ethanol butoxide,pyrenone 606,piperonylbutoxide,6-propylpiperonyl butyl diethylene glycol ether,butyl carbitol 6-propylpiperonyl ether,5-2-2-butoxyethoxy ethoxy methyl-6-propylbenzo d 1,3 dioxole,butoxide synergist
IUPAC Name	5-[2-(2-butoxyethoxy)ethoxymethyl]-6-propyl-1,3-benzodioxole
InChI Key	FIPWRIJSWJWJAI-UHFFFAOYSA-N
Molecular Formula	C19H30O5

1,3-Benzodioxole-5-sulfonyl chloride, 95%

CAS: 115010-10-1 Molecular Formula: C7H5ClO4S Molecular Weight (g/mol): 220.623 MDL Number: MFCD04974524 InChI Key: ICUBASIDCXDQAW-UHFFFAOYSA-N Synonym: benzo d 1,3 dioxole-5-sulfonyl chloride,benzo 1,3 dioxole-5-sulfonyl chloride,2h-1,3-benzodioxole-5-sulfonyl chloride,1,3-benzodioxole-5-sulfonylchloride,1,3-benzodioxole-5-sulphonyl chloride,acmc-20a4hu,5-chlorosulphonyl-1,3-benzodioxole,benzo 1,3 dioxol-5-sulfonyl chloride,benzo 1,3 dioxol-5-sulphonyl chloride,benzo 1,3-dioxol-5-sulphonyl chloride PubChem CID: 4913401 IUPAC Name: 1,3-benzodioxole-5-sulfonyl chloride SMILES: C1OC2=C(O1)C=C(C=C2)S(=O)(=O)Cl

Pricing and Availability
Specifications

PubChem CID	4913401
CAS	115010-10-1
Molecular Weight (g/mol)	220.623
MDL Number	MFCD04974524
SMILES	C1OC2=C(O1)C=C(C=C2)S(=O)(=O)Cl
Synonym	benzo d 1,3 dioxole-5-sulfonyl chloride,benzo 1,3 dioxole-5-sulfonyl chloride,2h-1,3-benzodioxole-5-sulfonyl chloride,1,3-benzodioxole-5-sulfonylchloride,1,3-benzodioxole-5-sulphonyl chloride,acmc-20a4hu,5-chlorosulphonyl-1,3-benzodioxole,benzo 1,3 dioxol-5-sulfonyl chloride,benzo 1,3 dioxol-5-sulphonyl chloride,benzo 1,3-dioxol-5-sulphonyl chloride
IUPAC Name	1,3-benzodioxole-5-sulfonyl chloride
InChI Key	ICUBASIDCXDQAW-UHFFFAOYSA-N
Molecular Formula	C7H5ClO4S

6-Nitropiperonyl alcohol, 98+%

CAS: 15341-08-9 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.15 MDL Number: MFCD00005825 InChI Key: LJXBRPHBDWIHPR-UHFFFAOYSA-N Synonym: 6-nitropiperonyl alcohol,6-nitrobenzo d 1,3 dioxol-5-yl methanol,3,4-methylenedioxy-6-nitrobenzyl alcohol,6-nitro-3,4-methylenedioxybenzyl alcohol,6-nitro-1,3-benzodioxol-5-yl methanol,6-nitro-2h-1,3-benzodioxol-5-yl methanol,6-nitro-1,3-benzodioxole-5-methanol,1,3-benzodioxole-5-methanol,6-nitro,1,3-benzodioxole-5-methanol, 6-nitro,6-nitro-1,3-benzodioxol-5-yl methanol # PubChem CID: 519111 IUPAC Name: (5-nitro-2H-1,3-benzodioxol-4-yl)methanol SMILES: OCC1=C2OCOC2=CC=C1[N+]([O-])=O

Pricing and Availability
Specifications

PubChem CID	519111
CAS	15341-08-9
Molecular Weight (g/mol)	197.15
MDL Number	MFCD00005825
SMILES	OCC1=C2OCOC2=CC=C1[N+]([O-])=O
Synonym	6-nitropiperonyl alcohol,6-nitrobenzo d 1,3 dioxol-5-yl methanol,3,4-methylenedioxy-6-nitrobenzyl alcohol,6-nitro-3,4-methylenedioxybenzyl alcohol,6-nitro-1,3-benzodioxol-5-yl methanol,6-nitro-2h-1,3-benzodioxol-5-yl methanol,6-nitro-1,3-benzodioxole-5-methanol,1,3-benzodioxole-5-methanol,6-nitro,1,3-benzodioxole-5-methanol, 6-nitro,6-nitro-1,3-benzodioxol-5-yl methanol #
IUPAC Name	(5-nitro-2H-1,3-benzodioxol-4-yl)methanol
InChI Key	LJXBRPHBDWIHPR-UHFFFAOYSA-N
Molecular Formula	C8H7NO5

3,4-(Methylenedioxy)aniline, 98+%

CAS: 14268-66-7 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.138 MDL Number: MFCD00005832 InChI Key: XGNXYCFREOZBOL-UHFFFAOYSA-N Synonym: 3,4-methylenedioxy aniline,benzo d 1,3 dioxol-5-amine,5-amino-1,3-benzodioxole,3,4-methylenedioxyaniline,4-amino-1,2-methylenedioxybenzene,5-aminobenzodioxole,methylenedioxyaniline,2h-1,3-benzodioxol-5-amine,1-amino-3,4-methylenedioxybenzene,1-amino-3,4-dimethylenedioxybenzene PubChem CID: 84310 IUPAC Name: 1,3-benzodioxol-5-amine SMILES: C1OC2=C(O1)C=C(C=C2)N

Pricing and Availability
Specifications

PubChem CID	84310
CAS	14268-66-7
Molecular Weight (g/mol)	137.138
MDL Number	MFCD00005832
SMILES	C1OC2=C(O1)C=C(C=C2)N
Synonym	3,4-methylenedioxy aniline,benzo d 1,3 dioxol-5-amine,5-amino-1,3-benzodioxole,3,4-methylenedioxyaniline,4-amino-1,2-methylenedioxybenzene,5-aminobenzodioxole,methylenedioxyaniline,2h-1,3-benzodioxol-5-amine,1-amino-3,4-methylenedioxybenzene,1-amino-3,4-dimethylenedioxybenzene
IUPAC Name	1,3-benzodioxol-5-amine
InChI Key	XGNXYCFREOZBOL-UHFFFAOYSA-N
Molecular Formula	C7H7NO2

5-Methoxypiperonal, 97%

CAS: 5780-07-4 MDL Number: MFCD00016900

Pricing and Availability
Specifications

CAS	5780-07-4
MDL Number	MFCD00016900

3,4-(Methylenedioxy)benzylideneacetone, 98%

CAS: 3160-37-0 Molecular Formula: C11H10O3 Molecular Weight (g/mol): 190.198 MDL Number: MFCD00016907 InChI Key: XIYPXOFSURQTTJ-NSCUHMNNSA-N Synonym: piperonalacetone,heliotropyl acetone,acetone, piperonylidene,piperonylideneacetone,piperonylidene acetone,unii-t43byj64eg,3-buten-2-one, 4-1,3-benzodioxol-5-yl,ccris 6270,3,4-methylenedioxy benzalacetone,3,4-methylenedioxy benzylideneacetone PubChem CID: 6040503 IUPAC Name: (E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one SMILES: CC(=O)C=CC1=CC2=C(C=C1)OCO2

Pricing and Availability
Specifications

PubChem CID	6040503
CAS	3160-37-0
Molecular Weight (g/mol)	190.198
MDL Number	MFCD00016907
SMILES	CC(=O)C=CC1=CC2=C(C=C1)OCO2
Synonym	piperonalacetone,heliotropyl acetone,acetone, piperonylidene,piperonylideneacetone,piperonylidene acetone,unii-t43byj64eg,3-buten-2-one, 4-1,3-benzodioxol-5-yl,ccris 6270,3,4-methylenedioxy benzalacetone,3,4-methylenedioxy benzylideneacetone
IUPAC Name	(E)-4-(1,3-benzodioxol-5-yl)but-3-en-2-one
InChI Key	XIYPXOFSURQTTJ-NSCUHMNNSA-N
Molecular Formula	C11H10O3

4-(3,4-Methylenedioxy)phenyl-2-butanone, 98%

CAS: 55418-52-5 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.214 MDL Number: MFCD00016910 InChI Key: TZJLGGWGVLADDN-UHFFFAOYSA-N Synonym: piperonyl acetone,piperonylacetone,4-3,4-methylenedioxyphenyl-2-butanone,4-1,3-benzodioxol-5-yl-2-butanone,4-1,3-benzodioxol-5-yl butan-2-one,2-butanone, 4-1,3-benzodioxol-5-yl,unii-081vvc9h34,fema no. 2701,3,4-methylenedioxybenzylacetone,4-benzo d 1,3 dioxol-5-yl butan-2-one PubChem CID: 62098 IUPAC Name: 4-(1,3-benzodioxol-5-yl)butan-2-one SMILES: CC(=O)CCC1=CC2=C(C=C1)OCO2

Pricing and Availability
Specifications

PubChem CID	62098
CAS	55418-52-5
Molecular Weight (g/mol)	192.214
MDL Number	MFCD00016910
SMILES	CC(=O)CCC1=CC2=C(C=C1)OCO2
Synonym	piperonyl acetone,piperonylacetone,4-3,4-methylenedioxyphenyl-2-butanone,4-1,3-benzodioxol-5-yl-2-butanone,4-1,3-benzodioxol-5-yl butan-2-one,2-butanone, 4-1,3-benzodioxol-5-yl,unii-081vvc9h34,fema no. 2701,3,4-methylenedioxybenzylacetone,4-benzo d 1,3 dioxol-5-yl butan-2-one
IUPAC Name	4-(1,3-benzodioxol-5-yl)butan-2-one
InChI Key	TZJLGGWGVLADDN-UHFFFAOYSA-N
Molecular Formula	C11H12O3

3,4-(Methylenedioxy)phenylacetonitrile, 98+%

CAS: 4439-02-5 Molecular Formula: C9H7NO2 Molecular Weight (g/mol): 161.16 MDL Number: MFCD00005835 InChI Key: ZQPBOYASBNAXOZ-UHFFFAOYSA-N Synonym: 3,4-methylenedioxy phenylacetonitrile,1,3-benzodioxole-5-acetonitrile,3,4-methylenedioxyphenylacetonitrile,2-benzo d 1,3 dioxol-5-yl acetonitrile,3,4-methylenedioxybenzyl cyanide,2-2h-1,3-benzodioxol-5-yl acetonitrile,1,3-benzodioxol-5-ylacetonitrile,2-1,3-benzodioxol-5-yl acetonitrile,3,4-methylenedioxybenzylcyanide,homopiperonylonitrile PubChem CID: 78178 IUPAC Name: 2-(1,3-benzodioxol-5-yl)acetonitrile SMILES: C1OC2=C(O1)C=C(C=C2)CC#N

Pricing and Availability
Specifications

PubChem CID	78178
CAS	4439-02-5
Molecular Weight (g/mol)	161.16
MDL Number	MFCD00005835
SMILES	C1OC2=C(O1)C=C(C=C2)CC#N
Synonym	3,4-methylenedioxy phenylacetonitrile,1,3-benzodioxole-5-acetonitrile,3,4-methylenedioxyphenylacetonitrile,2-benzo d 1,3 dioxol-5-yl acetonitrile,3,4-methylenedioxybenzyl cyanide,2-2h-1,3-benzodioxol-5-yl acetonitrile,1,3-benzodioxol-5-ylacetonitrile,2-1,3-benzodioxol-5-yl acetonitrile,3,4-methylenedioxybenzylcyanide,homopiperonylonitrile
IUPAC Name	2-(1,3-benzodioxol-5-yl)acetonitrile
InChI Key	ZQPBOYASBNAXOZ-UHFFFAOYSA-N
Molecular Formula	C9H7NO2

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