Organochlorides

Organic compounds that contain one or more chlorine atoms.

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n-Butyl Chloride (HPLC), Fisher Chemical™

CAS: 109-69-3 Molecular Formula: C4H9Cl Molecular Weight (g/mol): 92.57 InChI Key: VFWCMGCRMGJXDK-UHFFFAOYSA-N Synonym: butyl chloride,n-butyl chloride,butane, 1-chloro,chlorure de butyle,nbc wormer,n-propylcarbinyl chloride,sure shot,butane, chloro,chlorobutane,n-chlorobutane PubChem CID: 8005 IUPAC Name: 1-chlorobutane SMILES: CCCCCl

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Specifications

PubChem CID	8005
CAS	109-69-3
Molecular Weight (g/mol)	92.57
SMILES	CCCCCl
Synonym	butyl chloride,n-butyl chloride,butane, 1-chloro,chlorure de butyle,nbc wormer,n-propylcarbinyl chloride,sure shot,butane, chloro,chlorobutane,n-chlorobutane
IUPAC Name	1-chlorobutane
InChI Key	VFWCMGCRMGJXDK-UHFFFAOYSA-N
Molecular Formula	C4H9Cl

Ethyl 4-chlorobutyrate, 98%

CAS: 3153-36-4 Molecular Formula: C6H11ClO2 Molecular Weight (g/mol): 150.602 MDL Number: MFCD00001004 InChI Key: OPXNFHAILOHHFO-UHFFFAOYSA-N Synonym: ethyl 4-chlorobutyrate,butanoic acid, 4-chloro-, ethyl ester,ethyl gamma-chlorobutyrate,ethyl-4-chlorobutyrate,4-chloro-butyric acid ethyl ester,butyric acid, 4-chloro-, ethyl ester,ethyl .gamma.-chlorobutyrate,4-chlorobutyric acid ethyl ester,ethyl 4chlorobutyrate,acmc-1cqjw PubChem CID: 18474 IUPAC Name: ethyl 4-chlorobutanoate SMILES: CCOC(=O)CCCCl

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Specifications

PubChem CID	18474
CAS	3153-36-4
Molecular Weight (g/mol)	150.602
MDL Number	MFCD00001004
SMILES	CCOC(=O)CCCCl
Synonym	ethyl 4-chlorobutyrate,butanoic acid, 4-chloro-, ethyl ester,ethyl gamma-chlorobutyrate,ethyl-4-chlorobutyrate,4-chloro-butyric acid ethyl ester,butyric acid, 4-chloro-, ethyl ester,ethyl .gamma.-chlorobutyrate,4-chlorobutyric acid ethyl ester,ethyl 4chlorobutyrate,acmc-1cqjw
IUPAC Name	ethyl 4-chlorobutanoate
InChI Key	OPXNFHAILOHHFO-UHFFFAOYSA-N
Molecular Formula	C6H11ClO2

5-Chlorovaleronitrile, 97%, Thermo Scientific™

CAS: 6280-87-1 Molecular Formula: C5H8ClN Molecular Weight (g/mol): 117.58 MDL Number: MFCD00001977 InChI Key: JSAWFGSXRPCFSW-UHFFFAOYSA-N Synonym: 5-chlorovaleronitrile,pentanenitrile, 5-chloro,5-chloro-n-valeronitrile,valeronitrile, 5-chloro,5-chloro valeronitrile,.delta.-chlorovaleronitrile,snxhfhaiuzjp@,5-chlorovaieronitrile,4-chlorobutyl cyanide,delta-chlorovaleronitrile PubChem CID: 80474 IUPAC Name: 5-chloropentanenitrile SMILES: ClCCCCC#N

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Specifications

PubChem CID	80474
CAS	6280-87-1
Molecular Weight (g/mol)	117.58
MDL Number	MFCD00001977
SMILES	ClCCCCC#N
Synonym	5-chlorovaleronitrile,pentanenitrile, 5-chloro,5-chloro-n-valeronitrile,valeronitrile, 5-chloro,5-chloro valeronitrile,.delta.-chlorovaleronitrile,snxhfhaiuzjp@,5-chlorovaieronitrile,4-chlorobutyl cyanide,delta-chlorovaleronitrile
IUPAC Name	5-chloropentanenitrile
InChI Key	JSAWFGSXRPCFSW-UHFFFAOYSA-N
Molecular Formula	C5H8ClN

Ethyl chloroformate, 99%, AcroSeal™

CAS: 541-41-3 Molecular Formula: C₃H₅ClO₂ Molecular Weight (g/mol): 108.52 MDL Number: MFCD00000644 InChI Key: RIFGWPKJUGCATF-UHFFFAOYSA-N Synonym: ethyl chloroformate,ethyl chlorocarbonate,cathyl chloride,ethoxycarbonyl chloride,chloroformic acid ethyl ester,ethylchloroformate,carbonochloridic acid, ethyl ester,chloro ethoxy methanone,ethylchloorformiaat,etil cloroformiato PubChem CID: 10928 IUPAC Name: ethyl carbonochloridate SMILES: CCOC(=O)Cl

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Specifications

PubChem CID	10928
CAS	541-41-3
Molecular Weight (g/mol)	108.52
MDL Number	MFCD00000644
SMILES	CCOC(=O)Cl
Synonym	ethyl chloroformate,ethyl chlorocarbonate,cathyl chloride,ethoxycarbonyl chloride,chloroformic acid ethyl ester,ethylchloroformate,carbonochloridic acid, ethyl ester,chloro ethoxy methanone,ethylchloorformiaat,etil cloroformiato
IUPAC Name	ethyl carbonochloridate
InChI Key	RIFGWPKJUGCATF-UHFFFAOYSA-N
Molecular Formula	C₃H₅ClO₂

tert-Butyl chloride, 98+%

CAS: 507-20-0 Molecular Formula: C4H9Cl Molecular Weight (g/mol): 92.566 MDL Number: MFCD00000816 InChI Key: NBRKLOOSMBRFMH-UHFFFAOYSA-N Synonym: tert-butyl chloride,propane, 2-chloro-2-methyl,tert-butylchloride,chlorotrimethylmethane,trimethylchloromethane,2-chloroisobutane,t-butyl chloride,t-butylchloride,2-methyl-2-chloropropane,2-methyl-2-propyl chloride PubChem CID: 10486 IUPAC Name: 2-chloro-2-methylpropane SMILES: CC(C)(C)Cl

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Specifications

PubChem CID	10486
CAS	507-20-0
Molecular Weight (g/mol)	92.566
MDL Number	MFCD00000816
SMILES	CC(C)(C)Cl
Synonym	tert-butyl chloride,propane, 2-chloro-2-methyl,tert-butylchloride,chlorotrimethylmethane,trimethylchloromethane,2-chloroisobutane,t-butyl chloride,t-butylchloride,2-methyl-2-chloropropane,2-methyl-2-propyl chloride
IUPAC Name	2-chloro-2-methylpropane
InChI Key	NBRKLOOSMBRFMH-UHFFFAOYSA-N
Molecular Formula	C4H9Cl

1-chlorobutane, Sequenation Grade

CAS: 109-69-3 Molecular Formula: C4H9Cl Molecular Weight (g/mol): 92.57 MDL Number: MFCD00001009 InChI Key: VFWCMGCRMGJXDK-UHFFFAOYSA-N Synonym: butyl chloride,n-butyl chloride,butane, 1-chloro,chlorure de butyle,nbc wormer,n-propylcarbinyl chloride,sure shot,butane, chloro,chlorobutane,n-chlorobutane PubChem CID: 8005 IUPAC Name: 1-chlorobutane SMILES: CCCCCl

Pricing and Availability
Specifications

PubChem CID	8005
CAS	109-69-3
Molecular Weight (g/mol)	92.57
MDL Number	MFCD00001009
SMILES	CCCCCl
Synonym	butyl chloride,n-butyl chloride,butane, 1-chloro,chlorure de butyle,nbc wormer,n-propylcarbinyl chloride,sure shot,butane, chloro,chlorobutane,n-chlorobutane
IUPAC Name	1-chlorobutane
InChI Key	VFWCMGCRMGJXDK-UHFFFAOYSA-N
Molecular Formula	C4H9Cl

2,3-Dichloro-1-propene, 98%

CAS: 78-88-6 Molecular Formula: C3H4Cl2 Molecular Weight (g/mol): 110.965 MDL Number: MFCD00000943 InChI Key: FALCMQXTWHPRIH-UHFFFAOYSA-N Synonym: 2,3-dichloropropene,2,3-dichloro-1-propene,2-chloroallyl chloride,2,3-dichloropropylene,1-propene, 2,3-dichloro,propene, 2,3-dichloro,1,2-dichloro-2-propene,propylene, 2,3-dichloro,ccris 956,unii-370tnk5i41 PubChem CID: 6565 IUPAC Name: 2,3-dichloroprop-1-ene SMILES: C=C(CCl)Cl

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Specifications

PubChem CID	6565
CAS	78-88-6
Molecular Weight (g/mol)	110.965
MDL Number	MFCD00000943
SMILES	C=C(CCl)Cl
Synonym	2,3-dichloropropene,2,3-dichloro-1-propene,2-chloroallyl chloride,2,3-dichloropropylene,1-propene, 2,3-dichloro,propene, 2,3-dichloro,1,2-dichloro-2-propene,propylene, 2,3-dichloro,ccris 956,unii-370tnk5i41
IUPAC Name	2,3-dichloroprop-1-ene
InChI Key	FALCMQXTWHPRIH-UHFFFAOYSA-N
Molecular Formula	C3H4Cl2

Trichloroacetonitrile, 98%

CAS: 545-06-2 Molecular Formula: C₂Cl₃N Molecular Weight (g/mol): 144.39 InChI Key: DRUIESSIVFYOMK-UHFFFAOYSA-N Synonym: trichloroacetonitrile,acetonitrile, trichloro,tritox,cyanotrichloromethane,trichloromethyl cyanide,trichloroethanenitrile,trichlouracetonitril,trichlor-acetonitrile,trichloromethylnitrile,nitrile trichloracetique PubChem CID: 11011 ChEBI: CHEBI:82541 IUPAC Name: 2,2,2-trichloroacetonitrile SMILES: C(#N)C(Cl)(Cl)Cl

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Specifications

PubChem CID	11011
CAS	545-06-2
Molecular Weight (g/mol)	144.39
ChEBI	CHEBI:82541
SMILES	C(#N)C(Cl)(Cl)Cl
Synonym	trichloroacetonitrile,acetonitrile, trichloro,tritox,cyanotrichloromethane,trichloromethyl cyanide,trichloroethanenitrile,trichlouracetonitril,trichlor-acetonitrile,trichloromethylnitrile,nitrile trichloracetique
IUPAC Name	2,2,2-trichloroacetonitrile
InChI Key	DRUIESSIVFYOMK-UHFFFAOYSA-N
Molecular Formula	C₂Cl₃N

1,1,2,2-Tetrachloroethane, 98.5%

CAS: 79-34-5 MDL Number: MFCD00000848 InChI Key: QPFMBZIOSGYJDE-UHFFFAOYSA-N Synonym: s-tetrachloroethane,acetylene tetrachloride,ethane, 1,1,2,2-tetrachloro,bonoform,cellon,tetrachlorethane,sym-tetrachloroethane,westron,1,1,2,2-tetrachlorethane,1,1,2,2-tetrachloraethan PubChem CID: 6591 ChEBI: CHEBI:36026 IUPAC Name: 1,1,2,2-tetrachloroethane SMILES: C(C(Cl)Cl)(Cl)Cl

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Specifications

PubChem CID	6591
CAS	79-34-5
ChEBI	CHEBI:36026
MDL Number	MFCD00000848
SMILES	C(C(Cl)Cl)(Cl)Cl
Synonym	s-tetrachloroethane,acetylene tetrachloride,ethane, 1,1,2,2-tetrachloro,bonoform,cellon,tetrachlorethane,sym-tetrachloroethane,westron,1,1,2,2-tetrachlorethane,1,1,2,2-tetrachloraethan
IUPAC Name	1,1,2,2-tetrachloroethane
InChI Key	QPFMBZIOSGYJDE-UHFFFAOYSA-N

Benzyl chloroformate, 97 wt%, stabilized

CAS: 501-53-1 Molecular Formula: C₈H₇ClO₂ Molecular Weight (g/mol): 170.6 InChI Key: HSDAJNMJOMSNEV-UHFFFAOYSA-N Synonym: benzyl chloroformate,carbobenzoxy chloride,benzyl chlorocarbonate,cbz chloride,benzyloxycarbonyl chloride,carbobenzyloxy chloride,carbonochloridic acid, phenylmethyl ester,benzylcarbonyl chloride,cbz-cl,chloroformic acid, benzyl ester PubChem CID: 10387 IUPAC Name: benzyl carbonochloridate SMILES: C1=CC=C(C=C1)COC(=O)Cl

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Specifications

PubChem CID	10387
CAS	501-53-1
Molecular Weight (g/mol)	170.6
SMILES	C1=CC=C(C=C1)COC(=O)Cl
Synonym	benzyl chloroformate,carbobenzoxy chloride,benzyl chlorocarbonate,cbz chloride,benzyloxycarbonyl chloride,carbobenzyloxy chloride,carbonochloridic acid, phenylmethyl ester,benzylcarbonyl chloride,cbz-cl,chloroformic acid, benzyl ester
IUPAC Name	benzyl carbonochloridate
InChI Key	HSDAJNMJOMSNEV-UHFFFAOYSA-N
Molecular Formula	C₈H₇ClO₂

2-Chloro-2-methylbutane, 95%

CAS: 594-36-5 Molecular Formula: C5H11Cl Molecular Weight (g/mol): 106.593 MDL Number: MFCD00000818 InChI Key: CRNIHJHMEQZAAS-UHFFFAOYSA-N Synonym: tert-amyl chloride,butane, 2-chloro-2-methyl,2-methyl-2-chlorobutane,tert-pentyl chloride,1,1-dimethylpropyl chloride,tertiary pentyl chloride,t-pentyl chloride,acmc-209mdc,2-chloro-2-methyl butane,2-chloro-2-methyl-butane PubChem CID: 61143 IUPAC Name: 2-chloro-2-methylbutane SMILES: CCC(C)(C)Cl

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Specifications

PubChem CID	61143
CAS	594-36-5
Molecular Weight (g/mol)	106.593
MDL Number	MFCD00000818
SMILES	CCC(C)(C)Cl
Synonym	tert-amyl chloride,butane, 2-chloro-2-methyl,2-methyl-2-chlorobutane,tert-pentyl chloride,1,1-dimethylpropyl chloride,tertiary pentyl chloride,t-pentyl chloride,acmc-209mdc,2-chloro-2-methyl butane,2-chloro-2-methyl-butane
IUPAC Name	2-chloro-2-methylbutane
InChI Key	CRNIHJHMEQZAAS-UHFFFAOYSA-N
Molecular Formula	C5H11Cl

1-Chlorooctane, 99%

CAS: 111-85-3 Molecular Formula: C8H17Cl Molecular Weight (g/mol): 148.674 MDL Number: MFCD00001022 InChI Key: CNDHHGUSRIZDSL-UHFFFAOYSA-N Synonym: n-octyl chloride,octyl chloride,octane, 1-chloro,capryl chloride,chlorooctane,octane, chloro,1-octyl chloride,dsstox_cid_1543,dsstox_rid_76201,dsstox_gsid_21543 PubChem CID: 8142 IUPAC Name: 1-chlorooctane SMILES: CCCCCCCCCl

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Specifications

PubChem CID	8142
CAS	111-85-3
Molecular Weight (g/mol)	148.674
MDL Number	MFCD00001022
SMILES	CCCCCCCCCl
Synonym	n-octyl chloride,octyl chloride,octane, 1-chloro,capryl chloride,chlorooctane,octane, chloro,1-octyl chloride,dsstox_cid_1543,dsstox_rid_76201,dsstox_gsid_21543
IUPAC Name	1-chlorooctane
InChI Key	CNDHHGUSRIZDSL-UHFFFAOYSA-N
Molecular Formula	C8H17Cl

2-Chloro-2-methylpropane, 99%

CAS: 507-20-0 Molecular Formula: C₄H₉Cl Molecular Weight (g/mol): 92.57 MDL Number: MFCD00000816 InChI Key: NBRKLOOSMBRFMH-UHFFFAOYSA-N Synonym: tert-butyl chloride,propane, 2-chloro-2-methyl,tert-butylchloride,chlorotrimethylmethane,trimethylchloromethane,2-chloroisobutane,t-butyl chloride,t-butylchloride,2-methyl-2-chloropropane,2-methyl-2-propyl chloride PubChem CID: 10486 IUPAC Name: 2-chloro-2-methylpropane SMILES: CC(C)(C)Cl

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Specifications

PubChem CID	10486
CAS	507-20-0
Molecular Weight (g/mol)	92.57
MDL Number	MFCD00000816
SMILES	CC(C)(C)Cl
Synonym	tert-butyl chloride,propane, 2-chloro-2-methyl,tert-butylchloride,chlorotrimethylmethane,trimethylchloromethane,2-chloroisobutane,t-butyl chloride,t-butylchloride,2-methyl-2-chloropropane,2-methyl-2-propyl chloride
IUPAC Name	2-chloro-2-methylpropane
InChI Key	NBRKLOOSMBRFMH-UHFFFAOYSA-N
Molecular Formula	C₄H₉Cl

Allyl chloride, 98%, stabilized

CAS: 107-05-1 Molecular Formula: C₃H₅Cl Molecular Weight (g/mol): 76.53 MDL Number: MFCD00000984 InChI Key: OSDWBNJEKMUWAV-UHFFFAOYSA-N Synonym: allyl chloride,3-chloro-1-propene,1-propene, 3-chloro,3-chloropropylene,3-chloropropene,chlorallylene,allylchlorid,2-propenyl chloride,1-chloro-2-propene,allylchloride PubChem CID: 7850 ChEBI: CHEBI:82379 IUPAC Name: 3-chloroprop-1-ene SMILES: C=CCCl

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Specifications

PubChem CID	7850
CAS	107-05-1
Molecular Weight (g/mol)	76.53
ChEBI	CHEBI:82379
MDL Number	MFCD00000984
SMILES	C=CCCl
Synonym	allyl chloride,3-chloro-1-propene,1-propene, 3-chloro,3-chloropropylene,3-chloropropene,chlorallylene,allylchlorid,2-propenyl chloride,1-chloro-2-propene,allylchloride
IUPAC Name	3-chloroprop-1-ene
InChI Key	OSDWBNJEKMUWAV-UHFFFAOYSA-N
Molecular Formula	C₃H₅Cl

PubChem CID	8005
CAS	109-69-3
Molecular Weight (g/mol)	92.57
MDL Number	MFCD00001009
SMILES	CCCCCl
Synonym	butyl chloride,n-butyl chloride,butane, 1-chloro,chlorure de butyle,nbc wormer,n-propylcarbinyl chloride,sure shot,butane, chloro,chlorobutane,n-chlorobutane
IUPAC Name	1-chlorobutane
InChI Key	VFWCMGCRMGJXDK-UHFFFAOYSA-N
Molecular Formula	C4H9Cl

Organochlorides

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