Benzenoids
Filtered Search Results
5-Methoxy-2-nitrobenzoic acid, 97%
CAS: 1882-69-5 Molecular Formula: C8H6NO5 Molecular Weight (g/mol): 196.14 MDL Number: MFCD00151836 InChI Key: URADKXVAIGMTEG-UHFFFAOYSA-M Synonym: 5-methoxy-2-nitrobenzoic acid,2-nitro-5-methoxybenzoic acid,6-nitro-m-anisic acid,5-methoxy-2-nitro-benzoic acid,benzoic acid, 5-methoxy-2-nitro,pubchem4229,acmc-1brd6,2-nitro-5-methoxybenzoate,2-nitro-5-methoxybenzoicacid,5-methoxy-2-nitrobenzoicacid PubChem CID: 339209 IUPAC Name: 5-methoxy-2-nitrobenzoate SMILES: COC1=CC=C(C(=C1)C([O-])=O)[N+]([O-])=O
| PubChem CID | 339209 |
|---|---|
| CAS | 1882-69-5 |
| Molecular Weight (g/mol) | 196.14 |
| MDL Number | MFCD00151836 |
| SMILES | COC1=CC=C(C(=C1)C([O-])=O)[N+]([O-])=O |
| Synonym | 5-methoxy-2-nitrobenzoic acid,2-nitro-5-methoxybenzoic acid,6-nitro-m-anisic acid,5-methoxy-2-nitro-benzoic acid,benzoic acid, 5-methoxy-2-nitro,pubchem4229,acmc-1brd6,2-nitro-5-methoxybenzoate,2-nitro-5-methoxybenzoicacid,5-methoxy-2-nitrobenzoicacid |
| IUPAC Name | 5-methoxy-2-nitrobenzoate |
| InChI Key | URADKXVAIGMTEG-UHFFFAOYSA-M |
| Molecular Formula | C8H6NO5 |
4-(2-Thienyl)benzoic acid, 96%
CAS: 29886-62-2 Molecular Formula: C11H8O2S Molecular Weight (g/mol): 204.243 MDL Number: MFCD00690742 InChI Key: CVDUBQJEQNRCIZ-UHFFFAOYSA-N Synonym: 4-thiophen-2-yl benzoic acid,4-2-thienyl benzoic acid,4-thiophen-2-yl-benzoic acid,benzoic acid,4-2-thienyl,benzoic acid, 4-2-thienyl,pubchem12353,acmc-1cb4z,4-2-thienyl benzoicacid,4-thien-2-ylbenzoic acid,amtda058 PubChem CID: 736498 IUPAC Name: 4-thiophen-2-ylbenzoic acid SMILES: C1=CSC(=C1)C2=CC=C(C=C2)C(=O)O
| PubChem CID | 736498 |
|---|---|
| CAS | 29886-62-2 |
| Molecular Weight (g/mol) | 204.243 |
| MDL Number | MFCD00690742 |
| SMILES | C1=CSC(=C1)C2=CC=C(C=C2)C(=O)O |
| Synonym | 4-thiophen-2-yl benzoic acid,4-2-thienyl benzoic acid,4-thiophen-2-yl-benzoic acid,benzoic acid,4-2-thienyl,benzoic acid, 4-2-thienyl,pubchem12353,acmc-1cb4z,4-2-thienyl benzoicacid,4-thien-2-ylbenzoic acid,amtda058 |
| IUPAC Name | 4-thiophen-2-ylbenzoic acid |
| InChI Key | CVDUBQJEQNRCIZ-UHFFFAOYSA-N |
| Molecular Formula | C11H8O2S |
2-(3,5-Dimethyl-1H-pyrazol-4-yl)benzoic acid, 97%, Thermo Scientific™
CAS: 321309-43-7 Molecular Formula: C12H12N2O2 Molecular Weight (g/mol): 216.24 MDL Number: MFCD02682016 InChI Key: JNHKHFADRGJMJS-UHFFFAOYSA-N Synonym: 2-3,5-dimethyl-1h-pyrazol-4-yl benzoic acid,4-2-carboxyphenyl-3,5-dimethylpyrazole,benzoic acid,2-3,5-dimethyl-1h-pyrazol-4-yl,2-3,5-dimethylpyrazol-4-yl benzoic acid,2-3,5-dimethyl-1h-pyrazol-4-yl-benzoic acid PubChem CID: 2776446 IUPAC Name: 2-(3,5-dimethyl-1H-pyrazol-4-yl)benzoic acid SMILES: CC1=C(C(C)=NN1)C1=CC=CC=C1C(O)=O
| PubChem CID | 2776446 |
|---|---|
| CAS | 321309-43-7 |
| Molecular Weight (g/mol) | 216.24 |
| MDL Number | MFCD02682016 |
| SMILES | CC1=C(C(C)=NN1)C1=CC=CC=C1C(O)=O |
| Synonym | 2-3,5-dimethyl-1h-pyrazol-4-yl benzoic acid,4-2-carboxyphenyl-3,5-dimethylpyrazole,benzoic acid,2-3,5-dimethyl-1h-pyrazol-4-yl,2-3,5-dimethylpyrazol-4-yl benzoic acid,2-3,5-dimethyl-1h-pyrazol-4-yl-benzoic acid |
| IUPAC Name | 2-(3,5-dimethyl-1H-pyrazol-4-yl)benzoic acid |
| InChI Key | JNHKHFADRGJMJS-UHFFFAOYSA-N |
| Molecular Formula | C12H12N2O2 |
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
| 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 |
4-Cyanobenzoic acid, 98%
CAS: 619-65-8 Molecular Formula: C8H5NO2 Molecular Weight (g/mol): 147.133 MDL Number: MFCD00002528 InChI Key: ADCUEPOHPCPMCE-UHFFFAOYSA-N Synonym: p-cyanobenzoic acid,benzoic acid, 4-cyano,p-carboxybenzonitrile,4-carboxybenzonitrile,benzoic acid, p-cyano,4-cyano-benzoic acid,4-cyano benzoic acid,benzoicacid, 4-cyano,4-cyanobenzoicacid,para-cyanobenzoic acid PubChem CID: 12087 IUPAC Name: 4-cyanobenzoic acid SMILES: C1=CC(=CC=C1C#N)C(=O)O
| PubChem CID | 12087 |
|---|---|
| CAS | 619-65-8 |
| Molecular Weight (g/mol) | 147.133 |
| MDL Number | MFCD00002528 |
| SMILES | C1=CC(=CC=C1C#N)C(=O)O |
| Synonym | p-cyanobenzoic acid,benzoic acid, 4-cyano,p-carboxybenzonitrile,4-carboxybenzonitrile,benzoic acid, p-cyano,4-cyano-benzoic acid,4-cyano benzoic acid,benzoicacid, 4-cyano,4-cyanobenzoicacid,para-cyanobenzoic acid |
| IUPAC Name | 4-cyanobenzoic acid |
| InChI Key | ADCUEPOHPCPMCE-UHFFFAOYSA-N |
| Molecular Formula | C8H5NO2 |
3-(1H-1,2,4-Triazol-1-yl)benzoic acid, 97%, Thermo Scientific™
CAS: 167626-64-4 Molecular Formula: C9H7N3O2 Molecular Weight (g/mol): 189.174 MDL Number: MFCD08271895 InChI Key: SZKWCOCFEIVCAB-UHFFFAOYSA-N PubChem CID: 22224944 IUPAC Name: 3-(1,2,4-triazol-1-yl)benzoic acid SMILES: C1=CC(=CC(=C1)N2C=NC=N2)C(=O)O
| PubChem CID | 22224944 |
|---|---|
| CAS | 167626-64-4 |
| Molecular Weight (g/mol) | 189.174 |
| MDL Number | MFCD08271895 |
| SMILES | C1=CC(=CC(=C1)N2C=NC=N2)C(=O)O |
| IUPAC Name | 3-(1,2,4-triazol-1-yl)benzoic acid |
| InChI Key | SZKWCOCFEIVCAB-UHFFFAOYSA-N |
| Molecular Formula | C9H7N3O2 |
n-Hexyl benzoate, 98+%
CAS: 6789-88-4 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.285 MDL Number: MFCD00051714 InChI Key: UUGLJVMIFJNVFH-UHFFFAOYSA-N Synonym: benzoic acid, hexyl ester,benzoic acid n-hexyl ester,n-hexylbenzoate,n-hexyl benzoate,1-hexyl benzoate,hexylbenzoate,hexylester kyseliny benzoove,benzoic acid hexyl ester,unii-vr3c36ekjr,fema no. 3691 PubChem CID: 23235 IUPAC Name: hexyl benzoate SMILES: CCCCCCOC(=O)C1=CC=CC=C1
| PubChem CID | 23235 |
|---|---|
| CAS | 6789-88-4 |
| Molecular Weight (g/mol) | 206.285 |
| MDL Number | MFCD00051714 |
| SMILES | CCCCCCOC(=O)C1=CC=CC=C1 |
| Synonym | benzoic acid, hexyl ester,benzoic acid n-hexyl ester,n-hexylbenzoate,n-hexyl benzoate,1-hexyl benzoate,hexylbenzoate,hexylester kyseliny benzoove,benzoic acid hexyl ester,unii-vr3c36ekjr,fema no. 3691 |
| IUPAC Name | hexyl benzoate |
| InChI Key | UUGLJVMIFJNVFH-UHFFFAOYSA-N |
| Molecular Formula | C13H18O2 |
Homophthalic acid, 98%
CAS: 89-51-0 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.16 MDL Number: MFCD00004326 InChI Key: ZHQLTKAVLJKSKR-UHFFFAOYSA-N Synonym: homophthalic acid,2-carboxymethyl benzoic acid,benzeneacetic acid, 2-carboxy,2-carboxyphenylacetic acid,2-carboxybenzeneacetic acid,alpha-carboxy-o-toluic acid,o-carboxymethyl benzoic acid,2-carboxyphenyl acetic acid,o-toluic acid, alpha-carboxy,toluene-alpha,2-dicarboxylic acid PubChem CID: 66643 IUPAC Name: 2-(carboxymethyl)benzoic acid SMILES: C1=CC=C(C(=C1)CC(=O)O)C(=O)O
| PubChem CID | 66643 |
|---|---|
| CAS | 89-51-0 |
| Molecular Weight (g/mol) | 180.16 |
| MDL Number | MFCD00004326 |
| SMILES | C1=CC=C(C(=C1)CC(=O)O)C(=O)O |
| Synonym | homophthalic acid,2-carboxymethyl benzoic acid,benzeneacetic acid, 2-carboxy,2-carboxyphenylacetic acid,2-carboxybenzeneacetic acid,alpha-carboxy-o-toluic acid,o-carboxymethyl benzoic acid,2-carboxyphenyl acetic acid,o-toluic acid, alpha-carboxy,toluene-alpha,2-dicarboxylic acid |
| IUPAC Name | 2-(carboxymethyl)benzoic acid |
| InChI Key | ZHQLTKAVLJKSKR-UHFFFAOYSA-N |
| Molecular Formula | C9H8O4 |
Di-n-propyl phthalate, 98%
CAS: 131-16-8 Molecular Formula: C14H18O4 Molecular Weight (g/mol): 250.294 MDL Number: MFCD00009371 InChI Key: MQHNKCZKNAJROC-UHFFFAOYSA-N Synonym: dipropyl phthalate,di-n-propyl phthalate,di-n-propylphthalate,phthalic acid dipropyl ester,phthalic acid, dipropyl ester,phthalic acid di-n-propyl ester,1,2-benzenedicarboxylic acid, dipropyl ester,dipropylphthalate,n-dipropyl phthalate,unii-8usp5y77ss PubChem CID: 8559 ChEBI: CHEBI:60069 IUPAC Name: dipropyl benzene-1,2-dicarboxylate SMILES: CCCOC(=O)C1=CC=CC=C1C(=O)OCCC
| PubChem CID | 8559 |
|---|---|
| CAS | 131-16-8 |
| Molecular Weight (g/mol) | 250.294 |
| ChEBI | CHEBI:60069 |
| MDL Number | MFCD00009371 |
| SMILES | CCCOC(=O)C1=CC=CC=C1C(=O)OCCC |
| Synonym | dipropyl phthalate,di-n-propyl phthalate,di-n-propylphthalate,phthalic acid dipropyl ester,phthalic acid, dipropyl ester,phthalic acid di-n-propyl ester,1,2-benzenedicarboxylic acid, dipropyl ester,dipropylphthalate,n-dipropyl phthalate,unii-8usp5y77ss |
| IUPAC Name | dipropyl benzene-1,2-dicarboxylate |
| InChI Key | MQHNKCZKNAJROC-UHFFFAOYSA-N |
| Molecular Formula | C14H18O4 |
1,2-Dibenzoylethylene, predominantly trans, 96%
CAS: 959-28-4 Molecular Formula: C16H12O2 Molecular Weight (g/mol): 236.27 MDL Number: MFCD00003083 InChI Key: WYCXGQSQHAXLPK-VAWYXSNFSA-N Synonym: trans-1,2-dibenzoylethylene,dibenzoylethylene,1,2-dibenzoylethylene,1,4-diphenyl-2-butene-1,4-dione,trans-1,4-diphenyl-2-butene-1,4-dione,1,2-dibenzoylethene,ethylene, 1,2-dibenzoyl,usaf nd-57,2-butene-1,4-dione, 1,4-diphenyl,trans-diphenacylidene PubChem CID: 735960 IUPAC Name: (E)-1,4-diphenylbut-2-ene-1,4-dione SMILES: C1=CC=C(C=C1)C(=O)C=CC(=O)C2=CC=CC=C2
| PubChem CID | 735960 |
|---|---|
| CAS | 959-28-4 |
| Molecular Weight (g/mol) | 236.27 |
| MDL Number | MFCD00003083 |
| SMILES | C1=CC=C(C=C1)C(=O)C=CC(=O)C2=CC=CC=C2 |
| Synonym | trans-1,2-dibenzoylethylene,dibenzoylethylene,1,2-dibenzoylethylene,1,4-diphenyl-2-butene-1,4-dione,trans-1,4-diphenyl-2-butene-1,4-dione,1,2-dibenzoylethene,ethylene, 1,2-dibenzoyl,usaf nd-57,2-butene-1,4-dione, 1,4-diphenyl,trans-diphenacylidene |
| IUPAC Name | (E)-1,4-diphenylbut-2-ene-1,4-dione |
| InChI Key | WYCXGQSQHAXLPK-VAWYXSNFSA-N |
| Molecular Formula | C16H12O2 |
3,4,5-Trimethoxybenzaldehyde, 99%
CAS: 86-81-7 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.2 MDL Number: MFCD00003364 InChI Key: OPHQOIGEOHXOGX-UHFFFAOYSA-N PubChem CID: 6858 IUPAC Name: 3,4,5-trimethoxybenzaldehyde SMILES: COC1=CC(=CC(=C1OC)OC)C=O
| PubChem CID | 6858 |
|---|---|
| CAS | 86-81-7 |
| Molecular Weight (g/mol) | 196.2 |
| MDL Number | MFCD00003364 |
| SMILES | COC1=CC(=CC(=C1OC)OC)C=O |
| IUPAC Name | 3,4,5-trimethoxybenzaldehyde |
| InChI Key | OPHQOIGEOHXOGX-UHFFFAOYSA-N |
| Molecular Formula | C10H12O4 |
4-Methylbenzoic anhydride, 97%
CAS: 13222-85-0 Molecular Formula: C16H14O3 Molecular Weight (g/mol): 254.285 MDL Number: MFCD00048100 InChI Key: BJMLLSSSTGHJJE-UHFFFAOYSA-N Synonym: 4-methylbenzoic anhydride,4-methylphenyl anhydride,4-methylbenzoic acid anhydride,p-toluic anhydride,4-methylbenzene-1-carboxylic anhydride,4-methylbenzoyl 4-methylbenzoate,bis 4-methylbenzoic anhydride,p-toluylsaureanhydrid,para-toluic anhydride,4-methylbenzoicanhydride PubChem CID: 139413 IUPAC Name: (4-methylbenzoyl) 4-methylbenzoate SMILES: CC1=CC=C(C=C1)C(=O)OC(=O)C2=CC=C(C=C2)C
| PubChem CID | 139413 |
|---|---|
| CAS | 13222-85-0 |
| Molecular Weight (g/mol) | 254.285 |
| MDL Number | MFCD00048100 |
| SMILES | CC1=CC=C(C=C1)C(=O)OC(=O)C2=CC=C(C=C2)C |
| Synonym | 4-methylbenzoic anhydride,4-methylphenyl anhydride,4-methylbenzoic acid anhydride,p-toluic anhydride,4-methylbenzene-1-carboxylic anhydride,4-methylbenzoyl 4-methylbenzoate,bis 4-methylbenzoic anhydride,p-toluylsaureanhydrid,para-toluic anhydride,4-methylbenzoicanhydride |
| IUPAC Name | (4-methylbenzoyl) 4-methylbenzoate |
| InChI Key | BJMLLSSSTGHJJE-UHFFFAOYSA-N |
| Molecular Formula | C16H14O3 |
4-Chloro-3-fluorobenzaldehyde, 98%, Thermo Scientific Chemicals
CAS: 5527-95-7 MDL Number: MFCD00143288 InChI Key: AZMDWRPTDCIFRD-UHFFFAOYSA-N Synonym: 3-fluoro-4-chlorobenzaldehyde,4-chloro-3-fluorobenz-aldehyde,4-chloro-3-fluoro-benzaldehyde,benzaldehyde, 4-chloro-3-fluoro,pubchem1412,acmc-1amt7,ksc494a8n,4-chloro-3-fluoro benzaldehyde,azmdwrptdcifrd-uhfffaoysa PubChem CID: 2724985 IUPAC Name: 4-chloro-3-fluorobenzaldehyde SMILES: C1=CC(=C(C=C1C=O)F)Cl
| PubChem CID | 2724985 |
|---|---|
| CAS | 5527-95-7 |
| MDL Number | MFCD00143288 |
| SMILES | C1=CC(=C(C=C1C=O)F)Cl |
| Synonym | 3-fluoro-4-chlorobenzaldehyde,4-chloro-3-fluorobenz-aldehyde,4-chloro-3-fluoro-benzaldehyde,benzaldehyde, 4-chloro-3-fluoro,pubchem1412,acmc-1amt7,ksc494a8n,4-chloro-3-fluoro benzaldehyde,azmdwrptdcifrd-uhfffaoysa |
| IUPAC Name | 4-chloro-3-fluorobenzaldehyde |
| InChI Key | AZMDWRPTDCIFRD-UHFFFAOYSA-N |
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
| 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 |
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
| 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 |