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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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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Specifications

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

2,4,5-Trimethoxybenzaldehyde, 98%

CAS: 4460-86-0 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.20 MDL Number: MFCD00003312 InChI Key: IAJBQAYHSQIQRE-UHFFFAOYSA-N Synonym: asaraldehyde,asaronaldehyde,asarylaldehyde,azarylaldehyde,benzaldehyde, 2,4,5-trimethoxy,gazarin,3,4,6-trimethoxybenzaldehyde,unii-ndu8j2q00d,2,4,5-trimethoxy-benzaldehyde,ccris 1296 PubChem CID: 20525 IUPAC Name: 2,4,5-trimethoxybenzaldehyde SMILES: COC1=CC(OC)=C(C=O)C=C1OC

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Specifications

PubChem CID	20525
CAS	4460-86-0
Molecular Weight (g/mol)	196.20
MDL Number	MFCD00003312
SMILES	COC1=CC(OC)=C(C=O)C=C1OC
Synonym	asaraldehyde,asaronaldehyde,asarylaldehyde,azarylaldehyde,benzaldehyde, 2,4,5-trimethoxy,gazarin,3,4,6-trimethoxybenzaldehyde,unii-ndu8j2q00d,2,4,5-trimethoxy-benzaldehyde,ccris 1296
IUPAC Name	2,4,5-trimethoxybenzaldehyde
InChI Key	IAJBQAYHSQIQRE-UHFFFAOYSA-N
Molecular Formula	C10H12O4

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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Specifications

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

5-Chloro-2-fluorobenzaldehyde, 97%

CAS: 96515-79-6 Molecular Formula: C7H4ClFO Molecular Weight (g/mol): 158.56 MDL Number: MFCD03094518 InChI Key: WDTUCEMLUHTMCB-UHFFFAOYSA-N Synonym: 2-fluoro-5-chlorobenzaldehyde,3-chloro-6-fluoro benzaldehyde,3-chloro-6-fluorobenzaldehyde,5-chloro-2-fluoro-benzaldehyde,benzaldehyde, 5-chloro-2-fluoro,2-fluoro-5-chloro-benzaldehyde,zlchem 333,pubchem1411,ksc486m0t,2-fluoro-5-chloro benzaldehyde PubChem CID: 2773586 IUPAC Name: 5-chloro-2-fluorobenzaldehyde SMILES: FC1=CC=C(Cl)C=C1C=O

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Specifications

PubChem CID	2773586
CAS	96515-79-6
Molecular Weight (g/mol)	158.56
MDL Number	MFCD03094518
SMILES	FC1=CC=C(Cl)C=C1C=O
Synonym	2-fluoro-5-chlorobenzaldehyde,3-chloro-6-fluoro benzaldehyde,3-chloro-6-fluorobenzaldehyde,5-chloro-2-fluoro-benzaldehyde,benzaldehyde, 5-chloro-2-fluoro,2-fluoro-5-chloro-benzaldehyde,zlchem 333,pubchem1411,ksc486m0t,2-fluoro-5-chloro benzaldehyde
IUPAC Name	5-chloro-2-fluorobenzaldehyde
InChI Key	WDTUCEMLUHTMCB-UHFFFAOYSA-N
Molecular Formula	C7H4ClFO

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

3-Iodobenzaldehyde, 99%

CAS: 696-41-3 Molecular Formula: C₇H₅IO Molecular Weight (g/mol): 232.02 MDL Number: MFCD00039573 InChI Key: RZODAQZAFOBFLS-UHFFFAOYSA-N Synonym: 3-iodo-benzaldehyde,3-iodbenzaldehyd,benzaldehyde, 3-iodo,3-iodo benzaldehyde,3-iodanylbenzaldehyde,pubchem3917,acmc-1atsd,1-formyl-3-iodobenzene,m-iodobenzaldehyde,3-iodobenzaldehyde PubChem CID: 252610 IUPAC Name: 3-iodobenzaldehyde SMILES: C1=CC(=CC(=C1)I)C=O

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Specifications

PubChem CID	252610
CAS	696-41-3
Molecular Weight (g/mol)	232.02
MDL Number	MFCD00039573
SMILES	C1=CC(=CC(=C1)I)C=O
Synonym	3-iodo-benzaldehyde,3-iodbenzaldehyd,benzaldehyde, 3-iodo,3-iodo benzaldehyde,3-iodanylbenzaldehyde,pubchem3917,acmc-1atsd,1-formyl-3-iodobenzene,m-iodobenzaldehyde,3-iodobenzaldehyde
IUPAC Name	3-iodobenzaldehyde
InChI Key	RZODAQZAFOBFLS-UHFFFAOYSA-N
Molecular Formula	C₇H₅IO

4-Ethynylbenzaldehyde, 95%

CAS: 63697-96-1 Molecular Formula: C₉H₆O Molecular Weight (g/mol): 130.15 InChI Key: BGMHQBQFJYJLBP-UHFFFAOYSA-N PubChem CID: 2771645 IUPAC Name: 4-ethynylbenzaldehyde SMILES: C#CC1=CC=C(C=C1)C=O

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Specifications

PubChem CID	2771645
CAS	63697-96-1
Molecular Weight (g/mol)	130.15
SMILES	C#CC1=CC=C(C=C1)C=O
IUPAC Name	4-ethynylbenzaldehyde
InChI Key	BGMHQBQFJYJLBP-UHFFFAOYSA-N
Molecular Formula	C₉H₆O

Isopropyl 4-aminobenzoate, 98%

CAS: 18144-43-9 Molecular Formula: C10H13NO2 Molecular Weight (g/mol): 179.219 MDL Number: MFCD00017108 InChI Key: JWCPZKNBPMSYND-UHFFFAOYSA-N Synonym: isopropyl 4-aminobenzoate,4-amino-benzoic acid isopropyl ester,isopropyl p-aminobenzoate,4-aminobenzoic acid isopropyl ester,benzoic acid, 4-amino-, 1-methylethyl ester,benzoic acid, p-amino-, isopropyl ester,methylethyl 4-aminobenzoate,isopropyl-4-aminobenzoate,4-isopropoxycarbonylaniline,acmc-1brt8 PubChem CID: 87470 IUPAC Name: propan-2-yl 4-aminobenzoate SMILES: CC(C)OC(=O)C1=CC=C(C=C1)N

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Specifications

PubChem CID	87470
CAS	18144-43-9
Molecular Weight (g/mol)	179.219
MDL Number	MFCD00017108
SMILES	CC(C)OC(=O)C1=CC=C(C=C1)N
Synonym	isopropyl 4-aminobenzoate,4-amino-benzoic acid isopropyl ester,isopropyl p-aminobenzoate,4-aminobenzoic acid isopropyl ester,benzoic acid, 4-amino-, 1-methylethyl ester,benzoic acid, p-amino-, isopropyl ester,methylethyl 4-aminobenzoate,isopropyl-4-aminobenzoate,4-isopropoxycarbonylaniline,acmc-1brt8
IUPAC Name	propan-2-yl 4-aminobenzoate
InChI Key	JWCPZKNBPMSYND-UHFFFAOYSA-N
Molecular Formula	C10H13NO2

5-Bromo-2-methoxybenzaldehyde, 98+%

CAS: 25016-01-7 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD00003347 InChI Key: IJIBRSFAXRFPPN-UHFFFAOYSA-N Synonym: 5-bromo-2-anisaldehyde,5-bromo-o-anisaldehyde,2-methoxy-5-bromobenzaldehyde,benzaldehyde, 5-bromo-2-methoxy,5-bromo-2-methoxy-benzaldehyde,pubchem2644,acmc-209ggg,intermediates-zcf02672,o-anisaldehyde, 5-bromo,ksc494q2j PubChem CID: 90684 IUPAC Name: 5-bromo-2-methoxybenzaldehyde SMILES: COC1=C(C=C(C=C1)Br)C=O

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Specifications

PubChem CID	90684
CAS	25016-01-7
Molecular Weight (g/mol)	215.046
MDL Number	MFCD00003347
SMILES	COC1=C(C=C(C=C1)Br)C=O
Synonym	5-bromo-2-anisaldehyde,5-bromo-o-anisaldehyde,2-methoxy-5-bromobenzaldehyde,benzaldehyde, 5-bromo-2-methoxy,5-bromo-2-methoxy-benzaldehyde,pubchem2644,acmc-209ggg,intermediates-zcf02672,o-anisaldehyde, 5-bromo,ksc494q2j
IUPAC Name	5-bromo-2-methoxybenzaldehyde
InChI Key	IJIBRSFAXRFPPN-UHFFFAOYSA-N
Molecular Formula	C8H7BrO2

N-Methoxy-N-methylbenzamide, 98%

CAS: 6919-61-5 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.192 MDL Number: MFCD00075320 InChI Key: UKERDACREYXSIV-UHFFFAOYSA-N Synonym: n-methyl-n-methoxybenzamide,benzamide, n-methoxy-n-methyl,n-methoxy-n-methyl-benzamide,methyl n-methylbenzohydroxamate,pubchem17496,acmc-1b5bp,n-methoxy-n-methylbenzamid,n-methoxy-n-methyl benzamide,ksc445c3n,n-methoxy-n-methylbenzamide PubChem CID: 569575 ChEBI: CHEBI:59742 IUPAC Name: N-methoxy-N-methylbenzamide SMILES: CN(C(=O)C1=CC=CC=C1)OC

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Specifications

PubChem CID	569575
CAS	6919-61-5
Molecular Weight (g/mol)	165.192
ChEBI	CHEBI:59742
MDL Number	MFCD00075320
SMILES	CN(C(=O)C1=CC=CC=C1)OC
Synonym	n-methyl-n-methoxybenzamide,benzamide, n-methoxy-n-methyl,n-methoxy-n-methyl-benzamide,methyl n-methylbenzohydroxamate,pubchem17496,acmc-1b5bp,n-methoxy-n-methylbenzamid,n-methoxy-n-methyl benzamide,ksc445c3n,n-methoxy-n-methylbenzamide
IUPAC Name	N-methoxy-N-methylbenzamide
InChI Key	UKERDACREYXSIV-UHFFFAOYSA-N
Molecular Formula	C9H11NO2

Ethyl o-toluate, 98+%

CAS: 87-24-1 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00009112 InChI Key: SOUAXOGPALPTTC-UHFFFAOYSA-N Synonym: ethyl o-toluate,ethyl o-methylbenzoate,ethyl orthotoluate,2-methylbenzoic acid ethyl ester,benzoic acid, 2-methyl-, ethyl ester,ethyl-o-toluate,2-methyl-benzoic acid ethyl ester,o-toluic acid ethyl ester,ethyl-2-methylbenzoate,ethylo-toluate PubChem CID: 66598 IUPAC Name: ethyl 2-methylbenzoate SMILES: CCOC(=O)C1=CC=CC=C1C

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Specifications

PubChem CID	66598
CAS	87-24-1
Molecular Weight (g/mol)	164.204
MDL Number	MFCD00009112
SMILES	CCOC(=O)C1=CC=CC=C1C
Synonym	ethyl o-toluate,ethyl o-methylbenzoate,ethyl orthotoluate,2-methylbenzoic acid ethyl ester,benzoic acid, 2-methyl-, ethyl ester,ethyl-o-toluate,2-methyl-benzoic acid ethyl ester,o-toluic acid ethyl ester,ethyl-2-methylbenzoate,ethylo-toluate
IUPAC Name	ethyl 2-methylbenzoate
InChI Key	SOUAXOGPALPTTC-UHFFFAOYSA-N
Molecular Formula	C10H12O2

3-(4-Methoxybenzoyl)acrylic acid, 98%

CAS: 5711-41-1 Molecular Formula: C11H10O4 Molecular Weight (g/mol): 206.20 MDL Number: MFCD00020486 InChI Key: WORYXBDHTBWLLL-VOTSOKGWSA-N Synonym: 3-4-methoxybenzoyl acrylic acid,4-4-methoxyphenyl-4-oxobut-2-enoic acid,2e-4-4-methoxyphenyl-4-oxobut-2-enoic acid,3-p-methoxybenzoyl acrylic acid,acrylic acid, 3-p-methoxybenzoyl,trans-3-4-methoxybenzoyl acrylic acid,e-4-4-methoxyphenyl-4-oxobut-2-enoic acid,gamma-oxo-4-methoxybenzenecrotonic acid,4-4-methoxyphenyl-4-oxo-buten-2-saeure,4-4-methoxyphenyl-4-oxo-2-butenoic acid PubChem CID: 5355095 IUPAC Name: (E)-4-(4-methoxyphenyl)-4-oxobut-2-enoic acid SMILES: COC1=CC=C(C=C1)C(=O)\C=C\C(O)=O

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Specifications

PubChem CID	5355095
CAS	5711-41-1
Molecular Weight (g/mol)	206.20
MDL Number	MFCD00020486
SMILES	COC1=CC=C(C=C1)C(=O)\C=C\C(O)=O
Synonym	3-4-methoxybenzoyl acrylic acid,4-4-methoxyphenyl-4-oxobut-2-enoic acid,2e-4-4-methoxyphenyl-4-oxobut-2-enoic acid,3-p-methoxybenzoyl acrylic acid,acrylic acid, 3-p-methoxybenzoyl,trans-3-4-methoxybenzoyl acrylic acid,e-4-4-methoxyphenyl-4-oxobut-2-enoic acid,gamma-oxo-4-methoxybenzenecrotonic acid,4-4-methoxyphenyl-4-oxo-buten-2-saeure,4-4-methoxyphenyl-4-oxo-2-butenoic acid
IUPAC Name	(E)-4-(4-methoxyphenyl)-4-oxobut-2-enoic acid
InChI Key	WORYXBDHTBWLLL-VOTSOKGWSA-N
Molecular Formula	C11H10O4

Benzoylformic acid, 97%

CAS: 611-73-4 Molecular Formula: C8H6O3 Molecular Weight (g/mol): 150.13 MDL Number: MFCD00002575 InChI Key: FAQJJMHZNSSFSM-UHFFFAOYSA-N Synonym: benzoylformic acid,phenylglyoxylic acid,oxophenylacetic acid,benzeneglyoxylic acid,phenylgloxylic acid,2-phenylethanoic acid,oxo phenyl acetic acid,benzoylformate,phenylglyoxalate,phenyloxoacetic acid PubChem CID: 11915 ChEBI: CHEBI:18280 IUPAC Name: 2-oxo-2-phenylacetic acid SMILES: OC(=O)C(=O)C1=CC=CC=C1

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Specifications

PubChem CID	11915
CAS	611-73-4
Molecular Weight (g/mol)	150.13
ChEBI	CHEBI:18280
MDL Number	MFCD00002575
SMILES	OC(=O)C(=O)C1=CC=CC=C1
Synonym	benzoylformic acid,phenylglyoxylic acid,oxophenylacetic acid,benzeneglyoxylic acid,phenylgloxylic acid,2-phenylethanoic acid,oxo phenyl acetic acid,benzoylformate,phenylglyoxalate,phenyloxoacetic acid
IUPAC Name	2-oxo-2-phenylacetic acid
InChI Key	FAQJJMHZNSSFSM-UHFFFAOYSA-N
Molecular Formula	C8H6O3

3,5-Dibromobenzaldehyde, 98%

CAS: 56990-02-4 Molecular Formula: C7H4Br2O Molecular Weight (g/mol): 263.916 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

Pricing and Availability
Specifications

PubChem CID	622077
CAS	56990-02-4
Molecular Weight (g/mol)	263.916
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

4-Bromo-2,3-difluorobenzaldehyde, 98%

CAS: 644985-24-0 Molecular Formula: C7H3BrF2O Molecular Weight (g/mol): 221.001 MDL Number: MFCD09258953 InChI Key: IMOLPSNRLZLWQR-UHFFFAOYSA-N Synonym: 2,3-difluoro-4-bromobenzaldehyde,benzaldehyde, 4-bromo-2,3-difluoro,1-bromo-2,3-difluoro-4-formylbenzene,pubchem10068,4-bromo-2,3-difluoro-benzaldehyde,4-bromanyl-2,3-bis fluoranyl benzaldehyde,4-bromo-2, 3-difluorobenzaldehyde PubChem CID: 26986390 IUPAC Name: 4-bromo-2,3-difluorobenzaldehyde SMILES: C1=CC(=C(C(=C1C=O)F)F)Br

Pricing and Availability
Specifications

PubChem CID	26986390
CAS	644985-24-0
Molecular Weight (g/mol)	221.001
MDL Number	MFCD09258953
SMILES	C1=CC(=C(C(=C1C=O)F)F)Br
Synonym	2,3-difluoro-4-bromobenzaldehyde,benzaldehyde, 4-bromo-2,3-difluoro,1-bromo-2,3-difluoro-4-formylbenzene,pubchem10068,4-bromo-2,3-difluoro-benzaldehyde,4-bromanyl-2,3-bis fluoranyl benzaldehyde,4-bromo-2, 3-difluorobenzaldehyde
IUPAC Name	4-bromo-2,3-difluorobenzaldehyde
InChI Key	IMOLPSNRLZLWQR-UHFFFAOYSA-N
Molecular Formula	C7H3BrF2O

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