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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151 – 165 of 1,183 results

151

5-Iodo-2-methoxybenzaldehyde, 97%

CAS: 42298-41-9 Molecular Formula: C8H7IO2 Molecular Weight (g/mol): 262.05 MDL Number: MFCD04128999 InChI Key: PIRKMHAREMCDPZ-UHFFFAOYSA-N Synonym: 2-methoxy-5-iodobenzaldehyde,5-iodo-2-methoxy-benzaldehyde,pubchem1445,acmc-20am2z,benzaldehyde,5-iodo-2-methoxy,5-iodo-2-methoxybenzaldehyde PubChem CID: 262240 IUPAC Name: 5-iodo-2-methoxybenzaldehyde SMILES: COC1=CC=C(I)C=C1C=O

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Specifications

PubChem CID	262240
CAS	42298-41-9
Molecular Weight (g/mol)	262.05
MDL Number	MFCD04128999
SMILES	COC1=CC=C(I)C=C1C=O
Synonym	2-methoxy-5-iodobenzaldehyde,5-iodo-2-methoxy-benzaldehyde,pubchem1445,acmc-20am2z,benzaldehyde,5-iodo-2-methoxy,5-iodo-2-methoxybenzaldehyde
IUPAC Name	5-iodo-2-methoxybenzaldehyde
InChI Key	PIRKMHAREMCDPZ-UHFFFAOYSA-N
Molecular Formula	C8H7IO2

152

4-Formylbenzeneboronic acid pinacol ester, 98%

CAS: 128376-64-7 Molecular Formula: C13H17BO3 Molecular Weight (g/mol): 232.09 MDL Number: MFCD04972375 InChI Key: DMBMXJJGPXADPO-UHFFFAOYSA-N Synonym: 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzaldehyde,4-formylphenylboronic acid pinacol ester,4-formylbenzeneboronic acid, pinacol ester,4-formylphenylboronic acid pinacolate,4-formylphenylboronic acid pinacol cyclic ester,4-formylphenylboronic acid, pinacol ester,4-tetramethyl-1,3,2-dioxaborolan-2-yl benzaldehyde,4-formylbenzeneboronic acid pinacol ester,benzaldehyde, 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl,4-formylphenylboronic acid, pinacol cyclic ester PubChem CID: 2769536 IUPAC Name: 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde SMILES: CC1(C)OB(OC1(C)C)C1=CC=C(C=O)C=C1

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Specifications

PubChem CID	2769536
CAS	128376-64-7
Molecular Weight (g/mol)	232.09
MDL Number	MFCD04972375
SMILES	CC1(C)OB(OC1(C)C)C1=CC=C(C=O)C=C1
Synonym	4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl benzaldehyde,4-formylphenylboronic acid pinacol ester,4-formylbenzeneboronic acid, pinacol ester,4-formylphenylboronic acid pinacolate,4-formylphenylboronic acid pinacol cyclic ester,4-formylphenylboronic acid, pinacol ester,4-tetramethyl-1,3,2-dioxaborolan-2-yl benzaldehyde,4-formylbenzeneboronic acid pinacol ester,benzaldehyde, 4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl,4-formylphenylboronic acid, pinacol cyclic ester
IUPAC Name	4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde
InChI Key	DMBMXJJGPXADPO-UHFFFAOYSA-N
Molecular Formula	C13H17BO3

153

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

154

3-(1-Methyl-1H-pyrazol-3-yl)benzoic acid, 97%, Thermo Scientific™

CAS: 906352-85-0 Molecular Formula: C11H10N2O2 Molecular Weight (g/mol): 202.213 MDL Number: MFCD09065006 InChI Key: NQPMBEUYTBLTAG-UHFFFAOYSA-N Synonym: 3-1-methyl-1h-pyrazol-3-yl benzoic acid,3-1-methylpyrazol-3-yl benzoic acid,benzoicacid,3-1-methyl-1h-pyrazol-3-yl,3-3-carboxyphenyl-1-methyl-1h-pyrazole,benzoicacid, 3-1-methyl-1h-pyrazol-3-yl,benzoic acid, 3-1-methyl-1h-pyrazol-3-yl PubChem CID: 24229627 IUPAC Name: 3-(1-methylpyrazol-3-yl)benzoic acid SMILES: CN1C=CC(=N1)C2=CC(=CC=C2)C(=O)O

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Specifications

PubChem CID	24229627
CAS	906352-85-0
Molecular Weight (g/mol)	202.213
MDL Number	MFCD09065006
SMILES	CN1C=CC(=N1)C2=CC(=CC=C2)C(=O)O
Synonym	3-1-methyl-1h-pyrazol-3-yl benzoic acid,3-1-methylpyrazol-3-yl benzoic acid,benzoicacid,3-1-methyl-1h-pyrazol-3-yl,3-3-carboxyphenyl-1-methyl-1h-pyrazole,benzoicacid, 3-1-methyl-1h-pyrazol-3-yl,benzoic acid, 3-1-methyl-1h-pyrazol-3-yl
IUPAC Name	3-(1-methylpyrazol-3-yl)benzoic acid
InChI Key	NQPMBEUYTBLTAG-UHFFFAOYSA-N
Molecular Formula	C11H10N2O2

155

2,5-Dibromobenzaldehyde, 97%

CAS: 74553-29-0 Molecular Formula: C7H4Br2O Molecular Weight (g/mol): 263.916 MDL Number: MFCD00462864 InChI Key: BQBXKWGMPUCSQV-UHFFFAOYSA-N Synonym: benzaldehyde, 2,5-dibromo,2,5-dibromo-benzaldehyde,zlchem 813,acmc-20a0sm,2,5-di bromobenzaldehyde,ksc493q1h,2,5-dibromobenzaldehyde PubChem CID: 13540069 IUPAC Name: 2,5-dibromobenzaldehyde SMILES: C1=CC(=C(C=C1Br)C=O)Br

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Specifications

PubChem CID	13540069
CAS	74553-29-0
Molecular Weight (g/mol)	263.916
MDL Number	MFCD00462864
SMILES	C1=CC(=C(C=C1Br)C=O)Br
Synonym	benzaldehyde, 2,5-dibromo,2,5-dibromo-benzaldehyde,zlchem 813,acmc-20a0sm,2,5-di bromobenzaldehyde,ksc493q1h,2,5-dibromobenzaldehyde
IUPAC Name	2,5-dibromobenzaldehyde
InChI Key	BQBXKWGMPUCSQV-UHFFFAOYSA-N
Molecular Formula	C7H4Br2O

156

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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Specifications

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

157

3-Formylbenzeneboronic acid

CAS: 87199-16-4 Molecular Formula: C7H7BO3 Molecular Weight (g/mol): 149.94 MDL Number: MFCD00161356 InChI Key: HJBGZJMKTOMQRR-UHFFFAOYSA-N Synonym: 3-formylphenyl boronic acid,3-formylbenzeneboronic acid,3-boronobenzaldehyde,3-formyl phenylboronic acid,3-formylboronic acid,m-formylphenylboronic acid,3-dihydroxyboryl benzaldehyde,boronic acid, 3-formylphenyl,3-formylphenylboronicacid PubChem CID: 2734356 IUPAC Name: (3-formylphenyl)boronic acid SMILES: OB(O)C1=CC=CC(C=O)=C1

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Specifications

PubChem CID	2734356
CAS	87199-16-4
Molecular Weight (g/mol)	149.94
MDL Number	MFCD00161356
SMILES	OB(O)C1=CC=CC(C=O)=C1
Synonym	3-formylphenyl boronic acid,3-formylbenzeneboronic acid,3-boronobenzaldehyde,3-formyl phenylboronic acid,3-formylboronic acid,m-formylphenylboronic acid,3-dihydroxyboryl benzaldehyde,boronic acid, 3-formylphenyl,3-formylphenylboronicacid
IUPAC Name	(3-formylphenyl)boronic acid
InChI Key	HJBGZJMKTOMQRR-UHFFFAOYSA-N
Molecular Formula	C7H7BO3

158

Ethyl 3-benzoylacrylate, predominantly trans, 94%

CAS: 17450-56-5 Molecular Formula: C12H12O3 Molecular Weight (g/mol): 204.225 MDL Number: MFCD00011533 InChI Key: ACXLBHHUHSJENU-CMDGGOBGSA-N Synonym: ethyl 3-benzoylacrylate,ethyl 4-oxo-4-phenylbut-2-enoate,ethyl-3-benzoylacrylate,e-ethyl 4-oxo-4-phenylbut-2-enoate,ethyl trans-3-benzoylacrylate,trans-3-benzoylacrylic acid ethyl ester,ethyl 2e-4-oxo-4-phenylbut-2-enoate,ethyl e-4-oxo-4-phenylbut-2-enoate,trans-3-benzoylacrilic acid ethyl ester,ethyl=3-benzoylacrylate PubChem CID: 5369605 IUPAC Name: ethyl (E)-4-oxo-4-phenylbut-2-enoate SMILES: CCOC(=O)C=CC(=O)C1=CC=CC=C1

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Specifications

PubChem CID	5369605
CAS	17450-56-5
Molecular Weight (g/mol)	204.225
MDL Number	MFCD00011533
SMILES	CCOC(=O)C=CC(=O)C1=CC=CC=C1
Synonym	ethyl 3-benzoylacrylate,ethyl 4-oxo-4-phenylbut-2-enoate,ethyl-3-benzoylacrylate,e-ethyl 4-oxo-4-phenylbut-2-enoate,ethyl trans-3-benzoylacrylate,trans-3-benzoylacrylic acid ethyl ester,ethyl 2e-4-oxo-4-phenylbut-2-enoate,ethyl e-4-oxo-4-phenylbut-2-enoate,trans-3-benzoylacrilic acid ethyl ester,ethyl=3-benzoylacrylate
IUPAC Name	ethyl (E)-4-oxo-4-phenylbut-2-enoate
InChI Key	ACXLBHHUHSJENU-CMDGGOBGSA-N
Molecular Formula	C12H12O3

159

3-Ethoxy-4-methoxybenzaldehyde, 99%

CAS: 1131-52-8 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00010128 InChI Key: VAMZHXWLGRQSJS-UHFFFAOYSA-N Synonym: 3-ethoxy-4-methoxy-benzaldehyde,benzaldehyde, 3-ethoxy-4-methoxy,pubchem13135,3-ethoxy-p-anisaldehyde,acmc-1ca82,3-ethoxy-4methoxybenzaldehyde,3ethoxy-4-methoxybenzaldehyde,ksc183c6j,3-ethoxy-4-methoxybenzaldehyd,4-methoxy-3-ethoxybenzaldehyde PubChem CID: 244728 IUPAC Name: 3-ethoxy-4-methoxybenzaldehyde SMILES: CCOC1=C(C=CC(=C1)C=O)OC

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Specifications

PubChem CID	244728
CAS	1131-52-8
Molecular Weight (g/mol)	180.203
MDL Number	MFCD00010128
SMILES	CCOC1=C(C=CC(=C1)C=O)OC
Synonym	3-ethoxy-4-methoxy-benzaldehyde,benzaldehyde, 3-ethoxy-4-methoxy,pubchem13135,3-ethoxy-p-anisaldehyde,acmc-1ca82,3-ethoxy-4methoxybenzaldehyde,3ethoxy-4-methoxybenzaldehyde,ksc183c6j,3-ethoxy-4-methoxybenzaldehyd,4-methoxy-3-ethoxybenzaldehyde
IUPAC Name	3-ethoxy-4-methoxybenzaldehyde
InChI Key	VAMZHXWLGRQSJS-UHFFFAOYSA-N
Molecular Formula	C10H12O3

160

3-Biphenylcarboxylic acid, 97%

CAS: 716-76-7 Molecular Formula: C₁₃H₁₀O₂ Molecular Weight (g/mol): 198.22 MDL Number: MFCD00045846 InChI Key: XNLWJFYYOIRPIO-UHFFFAOYSA-N Synonym: biphenyl-3-carboxylic acid,3-biphenylcarboxylic acid,1,1'-biphenyl-3-carboxylic acid,diphenyl-3-carboxylic acid,wln: qvr cr,3-biphenylcarboxylicacid,m-phenylbenzoic acid,3-phenyl benzoic acid PubChem CID: 12854 IUPAC Name: 3-phenylbenzoic acid SMILES: C1=CC=C(C=C1)C2=CC(=CC=C2)C(=O)O

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Specifications

PubChem CID	12854
CAS	716-76-7
Molecular Weight (g/mol)	198.22
MDL Number	MFCD00045846
SMILES	C1=CC=C(C=C1)C2=CC(=CC=C2)C(=O)O
Synonym	biphenyl-3-carboxylic acid,3-biphenylcarboxylic acid,1,1'-biphenyl-3-carboxylic acid,diphenyl-3-carboxylic acid,wln: qvr cr,3-biphenylcarboxylicacid,m-phenylbenzoic acid,3-phenyl benzoic acid
IUPAC Name	3-phenylbenzoic acid
InChI Key	XNLWJFYYOIRPIO-UHFFFAOYSA-N
Molecular Formula	C₁₃H₁₀O₂

161

4-Fluorobenzaldehyde, 98%

CAS: 459-57-4 Molecular Formula: C7H5FO Molecular Weight (g/mol): 124.114 MDL Number: MFCD00003378 InChI Key: UOQXIWFBQSVDPP-UHFFFAOYSA-N Synonym: p-fluorobenzaldehyde,benzaldehyde, 4-fluoro,4-fluoro-benzaldehyde,para-fluorobenzaldehyde,p-fluorbenzaldehyde,fluorobenzaldehyde 4-,benzaldehyde, p-fluoro,pfad,4-fluoro benzaldehyde,para fluoro benzaldehyde PubChem CID: 68023 IUPAC Name: 4-fluorobenzaldehyde SMILES: C1=CC(=CC=C1C=O)F

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Specifications

PubChem CID	68023
CAS	459-57-4
Molecular Weight (g/mol)	124.114
MDL Number	MFCD00003378
SMILES	C1=CC(=CC=C1C=O)F
Synonym	p-fluorobenzaldehyde,benzaldehyde, 4-fluoro,4-fluoro-benzaldehyde,para-fluorobenzaldehyde,p-fluorbenzaldehyde,fluorobenzaldehyde 4-,benzaldehyde, p-fluoro,pfad,4-fluoro benzaldehyde,para fluoro benzaldehyde
IUPAC Name	4-fluorobenzaldehyde
InChI Key	UOQXIWFBQSVDPP-UHFFFAOYSA-N
Molecular Formula	C7H5FO

162

3-(2-Methyl-thiazol-4-yl)-benzaldehyde, 97%, Thermo Scientific™

CAS: 850375-05-2 Molecular Formula: C11H9NOS Molecular Weight (g/mol): 203.26 MDL Number: MFCD02681946 InChI Key: FQQPVEKQPGDYPD-UHFFFAOYSA-N PubChem CID: 7127782 IUPAC Name: 3-(2-methyl-1,3-thiazol-4-yl)benzaldehyde SMILES: CC1=NC(=CS1)C1=CC(C=O)=CC=C1

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Specifications

PubChem CID	7127782
CAS	850375-05-2
Molecular Weight (g/mol)	203.26
MDL Number	MFCD02681946
SMILES	CC1=NC(=CS1)C1=CC(C=O)=CC=C1
IUPAC Name	3-(2-methyl-1,3-thiazol-4-yl)benzaldehyde
InChI Key	FQQPVEKQPGDYPD-UHFFFAOYSA-N
Molecular Formula	C11H9NOS

163

Benzoyl isothiocyanate, 98%

CAS: 532-55-8 Molecular Formula: C8H5NOS Molecular Weight (g/mol): 163.194 MDL Number: MFCD00004815 InChI Key: CPEKAXYCDKETEN-UHFFFAOYSA-N Synonym: benzoylthiocarbimide,benzoylisothiocyanate,benzoylisothiocyante,isothiocyanic acid benzoyl ester,unii-u8j7q32b86,n-benzoyl isothiocyanate,benzoic acid, anhydride with hncs,benzoic acid, anhydride with isothiocyanic acid,oxophenylmethanisothiocyanate,1-benzoyl acetone PubChem CID: 68284 IUPAC Name: benzoyl isothiocyanate SMILES: C1=CC=C(C=C1)C(=O)N=C=S

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Specifications

PubChem CID	68284
CAS	532-55-8
Molecular Weight (g/mol)	163.194
MDL Number	MFCD00004815
SMILES	C1=CC=C(C=C1)C(=O)N=C=S
Synonym	benzoylthiocarbimide,benzoylisothiocyanate,benzoylisothiocyante,isothiocyanic acid benzoyl ester,unii-u8j7q32b86,n-benzoyl isothiocyanate,benzoic acid, anhydride with hncs,benzoic acid, anhydride with isothiocyanic acid,oxophenylmethanisothiocyanate,1-benzoyl acetone
IUPAC Name	benzoyl isothiocyanate
InChI Key	CPEKAXYCDKETEN-UHFFFAOYSA-N
Molecular Formula	C8H5NOS

164

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

165

PubChem CID	2734356
CAS	87199-16-4
Molecular Weight (g/mol)	149.94
MDL Number	MFCD00161356
SMILES	OB(O)C1=CC=CC(C=O)=C1
Synonym	3-formylphenyl boronic acid,3-formylbenzeneboronic acid,3-boronobenzaldehyde,3-formyl phenylboronic acid,3-formylboronic acid,m-formylphenylboronic acid,3-dihydroxyboryl benzaldehyde,boronic acid, 3-formylphenyl,3-formylphenylboronicacid
IUPAC Name	(3-formylphenyl)boronic acid
InChI Key	HJBGZJMKTOMQRR-UHFFFAOYSA-N
Molecular Formula	C7H7BO3

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