Benzoyl derivatives

Organic compounds that are derived from compounds that contain a benzoyl functional group, which has the following formula: C6H5CO-.

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1 – 15 of 505 results

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m-Toluic acid, 99%

CAS: 99-04-7 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00002523 InChI Key: GPSDUZXPYCFOSQ-UHFFFAOYSA-N Synonym: m-toluic acid,m-toluylic acid,3-toluic acid,benzoic acid, 3-methyl,meta-toluic acid,m-methylbenzoic acid,beta-methylbenzoic acid,3-methyl-benzoic acid,beta-bethylbenzoic acid,unii-1ua7k8eext PubChem CID: 7418 ChEBI: CHEBI:10589 IUPAC Name: 3-methylbenzoic acid SMILES: CC1=CC=CC(=C1)C(O)=O

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PubChem CID	7418
CAS	99-04-7
Molecular Weight (g/mol)	136.15
ChEBI	CHEBI:10589
MDL Number	MFCD00002523
SMILES	CC1=CC=CC(=C1)C(O)=O
Synonym	m-toluic acid,m-toluylic acid,3-toluic acid,benzoic acid, 3-methyl,meta-toluic acid,m-methylbenzoic acid,beta-methylbenzoic acid,3-methyl-benzoic acid,beta-bethylbenzoic acid,unii-1ua7k8eext
IUPAC Name	3-methylbenzoic acid
InChI Key	GPSDUZXPYCFOSQ-UHFFFAOYSA-N
Molecular Formula	C8H8O2

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Di-n-pentyl phthalate, 98%

CAS: 131-18-0 Molecular Formula: C18H26O4 Molecular Weight (g/mol): 306.402 MDL Number: MFCD00041934 InChI Key: IPKKHRVROFYTEK-UHFFFAOYSA-N Synonym: dipentyl phthalate,di-n-pentyl phthalate,diamyl phthalate,amyl phthalate,amoil,di-n-amyl phthalate,di-n-pentylphthalate,phthalic acid, dipentyl ester,phthalic acid diamyl ester,1,2-benzenedicarboxylic acid, dipentyl ester PubChem CID: 8561 ChEBI: CHEBI:34680 IUPAC Name: dipentyl benzene-1,2-dicarboxylate SMILES: CCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCC

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Specifications

PubChem CID	8561
CAS	131-18-0
Molecular Weight (g/mol)	306.402
ChEBI	CHEBI:34680
MDL Number	MFCD00041934
SMILES	CCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCC
Synonym	dipentyl phthalate,di-n-pentyl phthalate,diamyl phthalate,amyl phthalate,amoil,di-n-amyl phthalate,di-n-pentylphthalate,phthalic acid, dipentyl ester,phthalic acid diamyl ester,1,2-benzenedicarboxylic acid, dipentyl ester
IUPAC Name	dipentyl benzene-1,2-dicarboxylate
InChI Key	IPKKHRVROFYTEK-UHFFFAOYSA-N
Molecular Formula	C18H26O4

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p-Dimethylaminobenzaldehyde (Certified ACS), Fisher Chemical™

CAS: 100-10-7 Molecular Formula: C9H11NO Molecular Weight (g/mol): 149.19 MDL Number: MFCD00003381 InChI Key: BGNGWHSBYQYVRX-UHFFFAOYSA-N Synonym: 4-dimethylamino benzaldehyde,p-dimethylaminobenzaldehyde,ehrlich's reagent,p-formyldimethylaniline,benzaldehyde, 4-dimethylamino,p-dimethylamino benzaldehyde,p-formyl-n,n-dimethylaniline,n,n-dimethyl-p-aminobenzaldehyde,p-n,n-dimethylamino benzaldehyde,4-dimethylaminobenzenecarbonal PubChem CID: 7479 IUPAC Name: 4-(dimethylamino)benzaldehyde SMILES: CN(C)C1=CC=C(C=O)C=C1

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PubChem CID	7479
CAS	100-10-7
Molecular Weight (g/mol)	149.19
MDL Number	MFCD00003381
SMILES	CN(C)C1=CC=C(C=O)C=C1
Synonym	4-dimethylamino benzaldehyde,p-dimethylaminobenzaldehyde,ehrlich's reagent,p-formyldimethylaniline,benzaldehyde, 4-dimethylamino,p-dimethylamino benzaldehyde,p-formyl-n,n-dimethylaniline,n,n-dimethyl-p-aminobenzaldehyde,p-n,n-dimethylamino benzaldehyde,4-dimethylaminobenzenecarbonal
IUPAC Name	4-(dimethylamino)benzaldehyde
InChI Key	BGNGWHSBYQYVRX-UHFFFAOYSA-N
Molecular Formula	C9H11NO

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PubChem CID	7479
CAS	100-10-7
Molecular Weight (g/mol)	149.19
MDL Number	MFCD00003381
SMILES	CN(C)C1=CC=C(C=O)C=C1
Synonym	4-dimethylamino benzaldehyde,p-dimethylaminobenzaldehyde,ehrlich's reagent,p-formyldimethylaniline,benzaldehyde, 4-dimethylamino,p-dimethylamino benzaldehyde,p-formyl-n,n-dimethylaniline,n,n-dimethyl-p-aminobenzaldehyde,p-n,n-dimethylamino benzaldehyde,4-dimethylaminobenzenecarbonal
IUPAC Name	4-(dimethylamino)benzaldehyde
InChI Key	BGNGWHSBYQYVRX-UHFFFAOYSA-N
Molecular Formula	C9H11NO

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5-Chloro-2-methoxybenzaldehyde, 97%

CAS: 7035-09-8 MDL Number: MFCD00033854

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Specifications

CAS	7035-09-8
MDL Number	MFCD00033854

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3-Fluoro-2-formylbenzeneboronic acid, 95%

CAS: 871126-15-7 Molecular Formula: C7H6BFO3 Molecular Weight (g/mol): 167.93 MDL Number: MFCD10697421 InChI Key: GVHWLCYABLWGIR-UHFFFAOYSA-N Synonym: 3-fluoro-2-formylphenyl boronic acid,3-fluoro-2-formylbenzeneboronic acid,boronic acid, 3-fluoro-2-formylphenyl,acmc-209qf3,2-formyl-3-fluorophenylboranic acid,3-fluoro-2-formyl-phenyl boronic acid,3-fluoro-2-formylphenylboronic acid,boronic acid, b-3-fluoro-2-formylphenyl,contains varying amounts of anhydride PubChem CID: 53412038 IUPAC Name: (3-fluoro-2-formylphenyl)boronic acid SMILES: B(C1=C(C(=CC=C1)F)C=O)(O)O

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PubChem CID	53412038
CAS	871126-15-7
Molecular Weight (g/mol)	167.93
MDL Number	MFCD10697421
SMILES	B(C1=C(C(=CC=C1)F)C=O)(O)O
Synonym	3-fluoro-2-formylphenyl boronic acid,3-fluoro-2-formylbenzeneboronic acid,boronic acid, 3-fluoro-2-formylphenyl,acmc-209qf3,2-formyl-3-fluorophenylboranic acid,3-fluoro-2-formyl-phenyl boronic acid,3-fluoro-2-formylphenylboronic acid,boronic acid, b-3-fluoro-2-formylphenyl,contains varying amounts of anhydride
IUPAC Name	(3-fluoro-2-formylphenyl)boronic acid
InChI Key	GVHWLCYABLWGIR-UHFFFAOYSA-N
Molecular Formula	C7H6BFO3

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Ethyl mesitylglyoxylate, 97%

CAS: 5524-57-2 Molecular Formula: C13H16O3 Molecular Weight (g/mol): 220.268 MDL Number: MFCD00151821 InChI Key: XRSPPFOBPRPYLD-UHFFFAOYSA-N Synonym: ethyl mesitylglyoxylate,ethyl 2-mesityl-2-oxoacetate,ethyl 2-oxo-2-2,4,6-trimethylphenyl acetate,acmc-1asq7,mesitylglyoxylic acid ethyl ester,ethyl 2,4,6-trimethylphenyl glyoxylate,alpha-oxo-2,4,6-trimethylbenzeneacetic acid ethyl ester PubChem CID: 2736481 IUPAC Name: ethyl 2-oxo-2-(2,4,6-trimethylphenyl)acetate SMILES: CCOC(=O)C(=O)C1=C(C=C(C=C1C)C)C

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Specifications

PubChem CID	2736481
CAS	5524-57-2
Molecular Weight (g/mol)	220.268
MDL Number	MFCD00151821
SMILES	CCOC(=O)C(=O)C1=C(C=C(C=C1C)C)C
Synonym	ethyl mesitylglyoxylate,ethyl 2-mesityl-2-oxoacetate,ethyl 2-oxo-2-2,4,6-trimethylphenyl acetate,acmc-1asq7,mesitylglyoxylic acid ethyl ester,ethyl 2,4,6-trimethylphenyl glyoxylate,alpha-oxo-2,4,6-trimethylbenzeneacetic acid ethyl ester
IUPAC Name	ethyl 2-oxo-2-(2,4,6-trimethylphenyl)acetate
InChI Key	XRSPPFOBPRPYLD-UHFFFAOYSA-N
Molecular Formula	C13H16O3

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4-Formylphenylboronic acid, 97%

CAS: 87199-17-5 Molecular Formula: C7H7BO3 Molecular Weight (g/mol): 149.94 MDL Number: MFCD00151823 InChI Key: VXWBQOJISHAKKM-UHFFFAOYSA-N Synonym: 4-formylphenyl boronic acid,4-formylbenzeneboronic acid,4-boronobenzaldehyde,boronic acid, 4-formylphenyl,boronic acid, b-4-formylphenyl,p-formylphenylboronic acid,4-dihydroxyboryl benzaldehyde,4-dihydroxyboranyl benzaldehyde,4-benzaldehyde boronic acid,4-formyl-phenylboronic acid PubChem CID: 591073 IUPAC Name: (4-formylphenyl)boronic acid SMILES: OB(O)C1=CC=C(C=O)C=C1

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Specifications

PubChem CID	591073
CAS	87199-17-5
Molecular Weight (g/mol)	149.94
MDL Number	MFCD00151823
SMILES	OB(O)C1=CC=C(C=O)C=C1
Synonym	4-formylphenyl boronic acid,4-formylbenzeneboronic acid,4-boronobenzaldehyde,boronic acid, 4-formylphenyl,boronic acid, b-4-formylphenyl,p-formylphenylboronic acid,4-dihydroxyboryl benzaldehyde,4-dihydroxyboranyl benzaldehyde,4-benzaldehyde boronic acid,4-formyl-phenylboronic acid
IUPAC Name	(4-formylphenyl)boronic acid
InChI Key	VXWBQOJISHAKKM-UHFFFAOYSA-N
Molecular Formula	C7H7BO3

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2-Fluoro-5-formylbenzonitrile, 99%

CAS: 218301-22-5 Molecular Formula: C₈H₄FNO Molecular Weight (g/mol): 149.12 MDL Number: MFCD01863558 InChI Key: MOFRJTLODZILCR-UHFFFAOYSA-N Synonym: 3-cyano-4-fluorobenzaldehyde,4-fluoro-3-cyanobenzaldehyde,2-fluoro-5-formyl-benzonitrile,benzonitrile, 2-fluoro-5-formyl,2-fluoro-5-formylbenzenecarbonitrile,2-fluor-5-formylbenzonitrile,10014 2-fluoro-5-formyl benzonitrile,pubchem2252,acmc-1cfa9,fluoro-5-formylbenzonitrile PubChem CID: 2769582 IUPAC Name: 2-fluoro-5-formylbenzonitrile SMILES: C1=CC(=C(C=C1C=O)C#N)F

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Specifications

PubChem CID	2769582
CAS	218301-22-5
Molecular Weight (g/mol)	149.12
MDL Number	MFCD01863558
SMILES	C1=CC(=C(C=C1C=O)C#N)F
Synonym	3-cyano-4-fluorobenzaldehyde,4-fluoro-3-cyanobenzaldehyde,2-fluoro-5-formyl-benzonitrile,benzonitrile, 2-fluoro-5-formyl,2-fluoro-5-formylbenzenecarbonitrile,2-fluor-5-formylbenzonitrile,10014 2-fluoro-5-formyl benzonitrile,pubchem2252,acmc-1cfa9,fluoro-5-formylbenzonitrile
IUPAC Name	2-fluoro-5-formylbenzonitrile
InChI Key	MOFRJTLODZILCR-UHFFFAOYSA-N
Molecular Formula	C₈H₄FNO

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2-Fluoro-5-formylphenylboronic acid pinacol ester, 95%

CAS: 1112208-82-8 Molecular Formula: C13H16BFO3 Molecular Weight (g/mol): 250.08 MDL Number: MFCD11867877 InChI Key: WHYMLQVABFAGEK-UHFFFAOYSA-N Synonym: 2-fluoro-5-formylphenylboronic acid pinacol ester,4-fluoro-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzaldehyde,2-fluoro-5-formylphenylboronic acid, pinacol ester,2-fluoro-5-formylphenyl boronic acid pinacol ester,2-fluoro-5-formylbenzeneboronic acid pinacol ester,3-4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl-4-fluorobenzaldehyde,4-fluoro-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-benzaldehyde,benzaldehyde, 4-fluoro-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl PubChem CID: 46738018 IUPAC Name: 4-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde SMILES: CC1(C)OB(OC1(C)C)C1=C(F)C=CC(C=O)=C1

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Specifications

PubChem CID	46738018
CAS	1112208-82-8
Molecular Weight (g/mol)	250.08
MDL Number	MFCD11867877
SMILES	CC1(C)OB(OC1(C)C)C1=C(F)C=CC(C=O)=C1
Synonym	2-fluoro-5-formylphenylboronic acid pinacol ester,4-fluoro-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzaldehyde,2-fluoro-5-formylphenylboronic acid, pinacol ester,2-fluoro-5-formylphenyl boronic acid pinacol ester,2-fluoro-5-formylbenzeneboronic acid pinacol ester,3-4,4,5,5-tetramethyl-1,3,2-dioxaborolane-2-yl-4-fluorobenzaldehyde,4-fluoro-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl-benzaldehyde,benzaldehyde, 4-fluoro-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl
IUPAC Name	4-fluoro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde
InChI Key	WHYMLQVABFAGEK-UHFFFAOYSA-N
Molecular Formula	C13H16BFO3

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2-Iodo-5-methoxybenzaldehyde, 96%

CAS: 77287-58-2 Molecular Formula: C8H7IO2 Molecular Weight (g/mol): 262.046 MDL Number: MFCD18905098 InChI Key: YHRFMOFYYPMQBE-UHFFFAOYSA-N Synonym: benzaldehyde, 2-iodo-5-methoxy,5-methoxy-2-iodobenzaldehyde,2-iodo-5-methoxybenzaldehyde PubChem CID: 10858258 IUPAC Name: 2-iodo-5-methoxybenzaldehyde SMILES: COC1=CC(=C(C=C1)I)C=O

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Specifications

PubChem CID	10858258
CAS	77287-58-2
Molecular Weight (g/mol)	262.046
MDL Number	MFCD18905098
SMILES	COC1=CC(=C(C=C1)I)C=O
Synonym	benzaldehyde, 2-iodo-5-methoxy,5-methoxy-2-iodobenzaldehyde,2-iodo-5-methoxybenzaldehyde
IUPAC Name	2-iodo-5-methoxybenzaldehyde
InChI Key	YHRFMOFYYPMQBE-UHFFFAOYSA-N
Molecular Formula	C8H7IO2

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4-Fluoro-3-methoxybenzaldehyde, 98%

CAS: 128495-46-5 Molecular Formula: C8H7FO2 Molecular Weight (g/mol): 154.14 MDL Number: MFCD00143320 InChI Key: NALVGTOMKSKFFV-UHFFFAOYSA-N Synonym: 3-methoxy-4-fluorobenzaldehyde,4-fluoro-m-anisaldehyde,4-fluoro-3-methoxy-benzaldehyde,benzaldehyde, 4-fluoro-3-methoxy,pubchem1449,acmc-209bf6,ksc490m2d,3-methoxy-4-fluoro benzaldehyde,3-methoxy-4-fluoro-benzaldehyde,nalvgtomkskffv-uhfffaoysa PubChem CID: 2737358 IUPAC Name: 4-fluoro-3-methoxybenzaldehyde SMILES: COC1=CC(C=O)=CC=C1F

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Specifications

PubChem CID	2737358
CAS	128495-46-5
Molecular Weight (g/mol)	154.14
MDL Number	MFCD00143320
SMILES	COC1=CC(C=O)=CC=C1F
Synonym	3-methoxy-4-fluorobenzaldehyde,4-fluoro-m-anisaldehyde,4-fluoro-3-methoxy-benzaldehyde,benzaldehyde, 4-fluoro-3-methoxy,pubchem1449,acmc-209bf6,ksc490m2d,3-methoxy-4-fluoro benzaldehyde,3-methoxy-4-fluoro-benzaldehyde,nalvgtomkskffv-uhfffaoysa
IUPAC Name	4-fluoro-3-methoxybenzaldehyde
InChI Key	NALVGTOMKSKFFV-UHFFFAOYSA-N
Molecular Formula	C8H7FO2

Di-n-octyl phthalate, 98%

CAS: 117-84-0 Molecular Formula: C24H38O4 Molecular Weight (g/mol): 390.564 MDL Number: MFCD00015292 InChI Key: MQIUGAXCHLFZKX-UHFFFAOYSA-N Synonym: dioctyl phthalate,di-n-octyl phthalate,dinopol nop,n-octyl phthalate,vinicizer 85,phthalic acid, dioctyl ester,polycizer 162,dnop,phthalic acid di-n-octyl ester,dioctyl 1,2-benzenedicarboxylate PubChem CID: 8346 ChEBI: CHEBI:34679 IUPAC Name: dioctyl benzene-1,2-dicarboxylate SMILES: CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC

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Specifications

PubChem CID	8346
CAS	117-84-0
Molecular Weight (g/mol)	390.564
ChEBI	CHEBI:34679
MDL Number	MFCD00015292
SMILES	CCCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCCCC
Synonym	dioctyl phthalate,di-n-octyl phthalate,dinopol nop,n-octyl phthalate,vinicizer 85,phthalic acid, dioctyl ester,polycizer 162,dnop,phthalic acid di-n-octyl ester,dioctyl 1,2-benzenedicarboxylate
IUPAC Name	dioctyl benzene-1,2-dicarboxylate
InChI Key	MQIUGAXCHLFZKX-UHFFFAOYSA-N
Molecular Formula	C24H38O4

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3-Benzoylacrylic acid, predominantly trans, 97%

CAS: 583-06-2 Molecular Formula: C10H8O3 Molecular Weight (g/mol): 176.171 MDL Number: MFCD00014015 InChI Key: PLPDHGOODMBBGN-VOTSOKGWSA-N Synonym: 3-benzoylacrylic acid,benzoylacrylic acid,4-oxo-4-phenyl-2-butenoic acid,e-4-oxo-4-phenylbut-2-enoic acid,acrylic acid, 3-benzoyl,2-butenoic acid, 4-oxo-4-phenyl,4-oxo-4-phenylbut-2-enoic acid,crotonic acid, 4-oxo-4-phenyl,.beta.-benzoylacrylic acid,trans-3-benzoylacrylic acid PubChem CID: 676116 IUPAC Name: (E)-4-oxo-4-phenylbut-2-enoic acid SMILES: C1=CC=C(C=C1)C(=O)C=CC(=O)O

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Specifications

PubChem CID	676116
CAS	583-06-2
Molecular Weight (g/mol)	176.171
MDL Number	MFCD00014015
SMILES	C1=CC=C(C=C1)C(=O)C=CC(=O)O
Synonym	3-benzoylacrylic acid,benzoylacrylic acid,4-oxo-4-phenyl-2-butenoic acid,e-4-oxo-4-phenylbut-2-enoic acid,acrylic acid, 3-benzoyl,2-butenoic acid, 4-oxo-4-phenyl,4-oxo-4-phenylbut-2-enoic acid,crotonic acid, 4-oxo-4-phenyl,.beta.-benzoylacrylic acid,trans-3-benzoylacrylic acid
IUPAC Name	(E)-4-oxo-4-phenylbut-2-enoic acid
InChI Key	PLPDHGOODMBBGN-VOTSOKGWSA-N
Molecular Formula	C10H8O3

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Bis(2-ethylhexyl) phthalate, 98+%, Thermo Scientific Chemicals

CAS: 117-81-7 Molecular Formula: C24H38O4 Molecular Weight (g/mol): 390.564 MDL Number: MFCD00009493 InChI Key: BJQHLKABXJIVAM-UHFFFAOYSA-N Synonym: dehp,bis 2-ethylhexyl phthalate,di 2-ethylhexyl phthalate,diethylhexyl phthalate,di-sec-octyl phthalate,octyl phthalate,fleximel,octoil PubChem CID: 8343 ChEBI: CHEBI:17747 IUPAC Name: bis(2-ethylhexyl) benzene-1,2-dicarboxylate SMILES: CCCCC(CC)COC(=O)C1=CC=CC=C1C(=O)OCC(CC)CCCC

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Specifications

PubChem CID	8343
CAS	117-81-7
Molecular Weight (g/mol)	390.564
ChEBI	CHEBI:17747
MDL Number	MFCD00009493
SMILES	CCCCC(CC)COC(=O)C1=CC=CC=C1C(=O)OCC(CC)CCCC
Synonym	dehp,bis 2-ethylhexyl phthalate,di 2-ethylhexyl phthalate,diethylhexyl phthalate,di-sec-octyl phthalate,octyl phthalate,fleximel,octoil
IUPAC Name	bis(2-ethylhexyl) benzene-1,2-dicarboxylate
InChI Key	BJQHLKABXJIVAM-UHFFFAOYSA-N
Molecular Formula	C24H38O4

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