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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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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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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3-Bromo-4-methoxybenzaldehyde, 98%

CAS: 34841-06-0 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.05 MDL Number: MFCD00016599 InChI Key: QMPNFQLVIGPNEI-UHFFFAOYSA-N Synonym: 3-bromo-p-anisaldehyde,benzaldehyde, 3-bromo-4-methoxy,3-bromo-4-methoxy-benzaldehyde,3-bromoanisaldehyde,5-bromoanisaldehyde,3-bromo-anisaldehyde,5-bromo anisaldehyde,pubchem2643,acmc-209iat,2-bromo-4-formylanisole PubChem CID: 98662 IUPAC Name: 3-bromo-4-methoxybenzaldehyde SMILES: COC1=CC=C(C=O)C=C1Br

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PubChem CID	98662
CAS	34841-06-0
Molecular Weight (g/mol)	215.05
MDL Number	MFCD00016599
SMILES	COC1=CC=C(C=O)C=C1Br
Synonym	3-bromo-p-anisaldehyde,benzaldehyde, 3-bromo-4-methoxy,3-bromo-4-methoxy-benzaldehyde,3-bromoanisaldehyde,5-bromoanisaldehyde,3-bromo-anisaldehyde,5-bromo anisaldehyde,pubchem2643,acmc-209iat,2-bromo-4-formylanisole
IUPAC Name	3-bromo-4-methoxybenzaldehyde
InChI Key	QMPNFQLVIGPNEI-UHFFFAOYSA-N
Molecular Formula	C8H7BrO2

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4-Ethylbenzoic acid, 99%

CAS: 619-64-7 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00002570 InChI Key: ZQVKTHRQIXSMGY-UHFFFAOYSA-N Synonym: benzoic acid, 4-ethyl,p-ethylbenzoic acid,4-ethyl benzoic acid,4-ethyl-benzoic acid,unii-9tkm8p0g6r,9tkm8p0g6r,p-ethylbenzoate,4-ethyl benzoate,4-ethylbenzoicacid,p-ethylbenzoic acid; PubChem CID: 12086 IUPAC Name: 4-ethylbenzoic acid SMILES: CCC1=CC=C(C=C1)C(=O)O

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PubChem CID	12086
CAS	619-64-7
Molecular Weight (g/mol)	150.177
MDL Number	MFCD00002570
SMILES	CCC1=CC=C(C=C1)C(=O)O
Synonym	benzoic acid, 4-ethyl,p-ethylbenzoic acid,4-ethyl benzoic acid,4-ethyl-benzoic acid,unii-9tkm8p0g6r,9tkm8p0g6r,p-ethylbenzoate,4-ethyl benzoate,4-ethylbenzoicacid,p-ethylbenzoic acid;
IUPAC Name	4-ethylbenzoic acid
InChI Key	ZQVKTHRQIXSMGY-UHFFFAOYSA-N
Molecular Formula	C9H10O2

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Dipentyl phthalate, 97%

CAS: 131-18-0 Molecular Formula: C₁₈H₂₆O₄ Molecular Weight (g/mol): 306.4 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)	306.4
ChEBI	CHEBI:34680
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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2-Ethylbenzaldehyde, 97%

CAS: 22927-13-5 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.18 MDL Number: MFCD02261766 InChI Key: NTWBHJYRDKBGBR-UHFFFAOYSA-N Synonym: benzaldehyde, 2-ethyl,o-ethylbenzaldehyde,2-ethyl benzaldehyde,2-ethyl-benzaldehyde,ethylbenzaldehyde,2-ethyl-benzaldehyd,6-ethyl benzaldehyde,pubchem3074,acmc-20a49p PubChem CID: 123406 IUPAC Name: 2-ethylbenzaldehyde SMILES: CCC1=CC=CC=C1C=O

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Specifications

PubChem CID	123406
CAS	22927-13-5
Molecular Weight (g/mol)	134.18
MDL Number	MFCD02261766
SMILES	CCC1=CC=CC=C1C=O
Synonym	benzaldehyde, 2-ethyl,o-ethylbenzaldehyde,2-ethyl benzaldehyde,2-ethyl-benzaldehyde,ethylbenzaldehyde,2-ethyl-benzaldehyd,6-ethyl benzaldehyde,pubchem3074,acmc-20a49p
IUPAC Name	2-ethylbenzaldehyde
InChI Key	NTWBHJYRDKBGBR-UHFFFAOYSA-N
Molecular Formula	C9H10O

Benzoic acid, 99.6%, ACS reagent

CAS: 65-85-0 Molecular Formula: C₇H₆O₂ Molecular Weight (g/mol): 122.12 InChI Key: WPYMKLBDIGXBTP-UHFFFAOYSA-N Synonym: benzenecarboxylic acid,dracylic acid,benzeneformic acid,carboxybenzene,phenylformic acid,benzenemethanoic acid,phenylcarboxylic acid,retardex,benzoesaeure gk,benzoesaeure gv PubChem CID: 243 ChEBI: CHEBI:30746 IUPAC Name: benzoic acid SMILES: C1=CC=C(C=C1)C(=O)O

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Specifications

PubChem CID	243
CAS	65-85-0
Molecular Weight (g/mol)	122.12
ChEBI	CHEBI:30746
SMILES	C1=CC=C(C=C1)C(=O)O
Synonym	benzenecarboxylic acid,dracylic acid,benzeneformic acid,carboxybenzene,phenylformic acid,benzenemethanoic acid,phenylcarboxylic acid,retardex,benzoesaeure gk,benzoesaeure gv
IUPAC Name	benzoic acid
InChI Key	WPYMKLBDIGXBTP-UHFFFAOYSA-N
Molecular Formula	C₇H₆O₂

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2,4-Difluorobenzaldehyde, 98%

CAS: 1550-35-2 Molecular Formula: C7H4F2O Molecular Weight (g/mol): 142.11 MDL Number: MFCD00010326 InChI Key: WCGPCBACLBHDCI-UHFFFAOYSA-N PubChem CID: 73770 IUPAC Name: 2,4-difluorobenzaldehyde SMILES: FC1=CC=C(C=O)C(F)=C1

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PubChem CID	73770
CAS	1550-35-2
Molecular Weight (g/mol)	142.11
MDL Number	MFCD00010326
SMILES	FC1=CC=C(C=O)C(F)=C1
IUPAC Name	2,4-difluorobenzaldehyde
InChI Key	WCGPCBACLBHDCI-UHFFFAOYSA-N
Molecular Formula	C7H4F2O

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4-n-Pentylbenzaldehyde, 95%

CAS: 6853-57-2 Molecular Formula: C12H16O Molecular Weight (g/mol): 176.259 MDL Number: MFCD00043599 InChI Key: NQVZPRUSNWNSQH-UHFFFAOYSA-N Synonym: p-pentylbenzaldehyde,benzaldehyde, 4-pentyl,4-n-pentylbenzaldehyde,p-amylbenzaldehyde,4-n-amylbenzaldehyde,p-n-pentylbenzaldehyde,p-pentyl-benzaldehyde,p-n-pentylben-zaldehyde,p-pentylbenzaldehyde, i PubChem CID: 23290 IUPAC Name: 4-pentylbenzaldehyde SMILES: CCCCCC1=CC=C(C=C1)C=O

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Specifications

PubChem CID	23290
CAS	6853-57-2
Molecular Weight (g/mol)	176.259
MDL Number	MFCD00043599
SMILES	CCCCCC1=CC=C(C=C1)C=O
Synonym	p-pentylbenzaldehyde,benzaldehyde, 4-pentyl,4-n-pentylbenzaldehyde,p-amylbenzaldehyde,4-n-amylbenzaldehyde,p-n-pentylbenzaldehyde,p-pentyl-benzaldehyde,p-n-pentylben-zaldehyde,p-pentylbenzaldehyde, i
IUPAC Name	4-pentylbenzaldehyde
InChI Key	NQVZPRUSNWNSQH-UHFFFAOYSA-N
Molecular Formula	C12H16O

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3,4-Dibromobenzaldehyde, 99%

CAS: 74003-55-7 Molecular Formula: C7H4Br2O Molecular Weight (g/mol): 263.916 MDL Number: MFCD00236033 InChI Key: UTYRZXNEFUYFCJ-UHFFFAOYSA-N PubChem CID: 622053 IUPAC Name: 3,4-dibromobenzaldehyde SMILES: C1=CC(=C(C=C1C=O)Br)Br

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PubChem CID	622053
CAS	74003-55-7
Molecular Weight (g/mol)	263.916
MDL Number	MFCD00236033
SMILES	C1=CC(=C(C=C1C=O)Br)Br
IUPAC Name	3,4-dibromobenzaldehyde
InChI Key	UTYRZXNEFUYFCJ-UHFFFAOYSA-N
Molecular Formula	C7H4Br2O

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3,5-Dibromobenzaldehyde, 98+%

CAS: 56990-02-4 Molecular Formula: C₇H₄Br₂O Molecular Weight (g/mol): 263.91 MDL Number: MFCD00156887 InChI Key: ZLDMZIXUGCGKMB-UHFFFAOYSA-N Synonym: 3,5-dibromo-benzaldehyde,benzaldehyde, 3,5-dibromo,pubchem3069,acmc-209lvd,ksc493o2p,3,5-bis bromanyl benzaldehyde,paragos 530307,3,5-dibromo-phenyl-methanone PubChem CID: 622077 IUPAC Name: 3,5-dibromobenzaldehyde SMILES: C1=C(C=C(C=C1Br)Br)C=O

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Specifications

PubChem CID	622077
CAS	56990-02-4
Molecular Weight (g/mol)	263.91
MDL Number	MFCD00156887
SMILES	C1=C(C=C(C=C1Br)Br)C=O
Synonym	3,5-dibromo-benzaldehyde,benzaldehyde, 3,5-dibromo,pubchem3069,acmc-209lvd,ksc493o2p,3,5-bis bromanyl benzaldehyde,paragos 530307,3,5-dibromo-phenyl-methanone
IUPAC Name	3,5-dibromobenzaldehyde
InChI Key	ZLDMZIXUGCGKMB-UHFFFAOYSA-N
Molecular Formula	C₇H₄Br₂O

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4-n-Octylbenzoic acid, 99%

CAS: 3575-31-3 Molecular Formula: C15H22O2 Molecular Weight (g/mol): 234.339 MDL Number: MFCD00042649 InChI Key: ZQLDNJKHLQOJGE-UHFFFAOYSA-N Synonym: 4-n-octylbenzoic acid,benzoic acid, 4-octyl,p-octylbenzoic acid,para-octylbenzoic acid,benzoic acid, p-octyl,p-n-octyl benzoic acid,p-octyl benzoic acid,4-n-octylbenzoicacid,p-n-octylbenzoic acid,maybridge1_001984 PubChem CID: 19147 IUPAC Name: 4-octylbenzoic acid SMILES: CCCCCCCCC1=CC=C(C=C1)C(=O)O

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Specifications

PubChem CID	19147
CAS	3575-31-3
Molecular Weight (g/mol)	234.339
MDL Number	MFCD00042649
SMILES	CCCCCCCCC1=CC=C(C=C1)C(=O)O
Synonym	4-n-octylbenzoic acid,benzoic acid, 4-octyl,p-octylbenzoic acid,para-octylbenzoic acid,benzoic acid, p-octyl,p-n-octyl benzoic acid,p-octyl benzoic acid,4-n-octylbenzoicacid,p-n-octylbenzoic acid,maybridge1_001984
IUPAC Name	4-octylbenzoic acid
InChI Key	ZQLDNJKHLQOJGE-UHFFFAOYSA-N
Molecular Formula	C15H22O2

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4-Cyanobenzaldehyde, 98+%

CAS: 105-07-7 Molecular Formula: C8H5NO Molecular Weight (g/mol): 131.13 MDL Number: MFCD00003376 InChI Key: WZWIQYMTQZCSKI-UHFFFAOYSA-N Synonym: 4-cyanobenzaldehyde,benzonitrile, 4-formyl,p-cyanobenzaldehyde,p-formylbenzonitrile,benzaldehyde, p-cyano,benzonitrile, p-formyl,usaf kf-1,terephthalaldehydonitrile,p-cyanobenzenecarboxaldehyde,4-formyl-benzonitrile PubChem CID: 66042 IUPAC Name: 4-formylbenzonitrile SMILES: O=CC1=CC=C(C=C1)C#N

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Specifications

PubChem CID	66042
CAS	105-07-7
Molecular Weight (g/mol)	131.13
MDL Number	MFCD00003376
SMILES	O=CC1=CC=C(C=C1)C#N
Synonym	4-cyanobenzaldehyde,benzonitrile, 4-formyl,p-cyanobenzaldehyde,p-formylbenzonitrile,benzaldehyde, p-cyano,benzonitrile, p-formyl,usaf kf-1,terephthalaldehydonitrile,p-cyanobenzenecarboxaldehyde,4-formyl-benzonitrile
IUPAC Name	4-formylbenzonitrile
InChI Key	WZWIQYMTQZCSKI-UHFFFAOYSA-N
Molecular Formula	C8H5NO

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2-Bromobenzaldehyde, 98%

CAS: 6630-33-7 Molecular Formula: C7H5BrO Molecular Weight (g/mol): 185.02 MDL Number: MFCD00003300 InChI Key: NDOPHXWIAZIXPR-UHFFFAOYSA-N Synonym: o-bromobenzaldehyde,benzaldehyde, 2-bromo,benzaldehyde, o-bromo,2-bromo benzaldehyde,bromobenzaldehyde,bromo benzaldehyde,o-bromo-benzaldehyde,2-formylbromobenzene,2-bromo-benzaldehyde,benzaldehyde, bromo PubChem CID: 81129 IUPAC Name: 2-bromobenzaldehyde SMILES: BrC1=CC=CC=C1C=O

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Specifications

PubChem CID	81129
CAS	6630-33-7
Molecular Weight (g/mol)	185.02
MDL Number	MFCD00003300
SMILES	BrC1=CC=CC=C1C=O
Synonym	o-bromobenzaldehyde,benzaldehyde, 2-bromo,benzaldehyde, o-bromo,2-bromo benzaldehyde,bromobenzaldehyde,bromo benzaldehyde,o-bromo-benzaldehyde,2-formylbromobenzene,2-bromo-benzaldehyde,benzaldehyde, bromo
IUPAC Name	2-bromobenzaldehyde
InChI Key	NDOPHXWIAZIXPR-UHFFFAOYSA-N
Molecular Formula	C7H5BrO

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