Benzenoids
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Flufenamic Acid, Spectrum™ Chemical
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CAS: 530-78-9
| CAS | 530-78-9 |
|---|
Heptyl 4-Hydroxybenzoate, Spectrum™ Chemical
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CAS: 1085-12-7 Molecular Formula: C14H20O3 Molecular Weight (g/mol): 236.31 InChI Key: ZTJORNVITHUQJA-UHFFFAOYSA-N IUPAC Name: heptyl 4-hydroxybenzoate SMILES: CCCCCCCOC(=O)C1=CC=C(O)C=C1
| CAS | 1085-12-7 |
|---|---|
| Molecular Weight (g/mol) | 236.31 |
| SMILES | CCCCCCCOC(=O)C1=CC=C(O)C=C1 |
| IUPAC Name | heptyl 4-hydroxybenzoate |
| InChI Key | ZTJORNVITHUQJA-UHFFFAOYSA-N |
| Molecular Formula | C14H20O3 |
p-Toluenesulfonic anhydride, 95%
CAS: 4124-41-8 Molecular Formula: C14H14O5S2 Molecular Weight (g/mol): 326.39 MDL Number: MFCD00008548 InChI Key: PDVFSPNIEOYOQL-UHFFFAOYSA-N Synonym: p-toluenesulfonic anhydride,4-methylbenzenesulfonic anhydride,4-toluenesulfonic anhydride,p-toluenesulfonicanhydride,p-toluene sulfonic anhydride,toluene-p-sulphonic anhydride,4-methylphenyl sulfonyl 4-methylbenzenesulfonate,p-toluenesulphonic anhydride,toluene-4-sulfonic anhydride,benzenesulfonic acid, 4-methyl-, anhydride PubChem CID: 77773 IUPAC Name: (4-methylphenyl)sulfonyl 4-methylbenzenesulfonate SMILES: CC1=CC=C(C=C1)S(=O)(=O)OS(=O)(=O)C2=CC=C(C=C2)C
| PubChem CID | 77773 |
|---|---|
| CAS | 4124-41-8 |
| Molecular Weight (g/mol) | 326.39 |
| MDL Number | MFCD00008548 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)OS(=O)(=O)C2=CC=C(C=C2)C |
| Synonym | p-toluenesulfonic anhydride,4-methylbenzenesulfonic anhydride,4-toluenesulfonic anhydride,p-toluenesulfonicanhydride,p-toluene sulfonic anhydride,toluene-p-sulphonic anhydride,4-methylphenyl sulfonyl 4-methylbenzenesulfonate,p-toluenesulphonic anhydride,toluene-4-sulfonic anhydride,benzenesulfonic acid, 4-methyl-, anhydride |
| IUPAC Name | (4-methylphenyl)sulfonyl 4-methylbenzenesulfonate |
| InChI Key | PDVFSPNIEOYOQL-UHFFFAOYSA-N |
| Molecular Formula | C14H14O5S2 |
2-Fluorobenzaldehyde, 97%
CAS: 446-52-6 Molecular Formula: C7H5FO Molecular Weight (g/mol): 124.114 MDL Number: MFCD00003302 InChI Key: ZWDVQMVZZYIAHO-UHFFFAOYSA-N Synonym: o-fluorobenzaldehyde,benzaldehyde, 2-fluoro,benzaldehyde, o-fluoro,unii-7zx20dxb9z,2-fluor-benzaldehyd,2-fluoro-benzaldehyde,benzaldehyde, fluoro,ortho-fluorobenzaldehyde,7zx20dxb9z,fluorobenzaldehyde PubChem CID: 67970 IUPAC Name: 2-fluorobenzaldehyde SMILES: C1=CC=C(C(=C1)C=O)F
| PubChem CID | 67970 |
|---|---|
| CAS | 446-52-6 |
| Molecular Weight (g/mol) | 124.114 |
| MDL Number | MFCD00003302 |
| SMILES | C1=CC=C(C(=C1)C=O)F |
| Synonym | o-fluorobenzaldehyde,benzaldehyde, 2-fluoro,benzaldehyde, o-fluoro,unii-7zx20dxb9z,2-fluor-benzaldehyd,2-fluoro-benzaldehyde,benzaldehyde, fluoro,ortho-fluorobenzaldehyde,7zx20dxb9z,fluorobenzaldehyde |
| IUPAC Name | 2-fluorobenzaldehyde |
| InChI Key | ZWDVQMVZZYIAHO-UHFFFAOYSA-N |
| Molecular Formula | C7H5FO |
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
| 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 |
2-Chloro-6-methylbenzaldehyde, 98%
CAS: 1194-64-5 Molecular Formula: C8H7ClO Molecular Weight (g/mol): 154.593 MDL Number: MFCD01934409 InChI Key: CCYFXIJPJFSTSU-UHFFFAOYSA-N PubChem CID: 12467050 IUPAC Name: 2-chloro-6-methylbenzaldehyde SMILES: CC1=C(C(=CC=C1)Cl)C=O
| PubChem CID | 12467050 |
|---|---|
| CAS | 1194-64-5 |
| Molecular Weight (g/mol) | 154.593 |
| MDL Number | MFCD01934409 |
| SMILES | CC1=C(C(=CC=C1)Cl)C=O |
| IUPAC Name | 2-chloro-6-methylbenzaldehyde |
| InChI Key | CCYFXIJPJFSTSU-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO |
2-Bromo-3-fluorobenzaldehyde, 98%
CAS: 891180-59-9 Molecular Formula: C7H4BrFO Molecular Weight (g/mol): 203.01 MDL Number: MFCD07782044 InChI Key: CYJBMGYWRHGZBR-UHFFFAOYSA-N Synonym: 2-bromo-3-fluoro-benzaldehyde,benzaldehyde, 2-bromo-3-fluoro,pubchem1417,pubchem22500,acmc-1bwut,ksc494e8j,6-fluoro-2-formylbromobenzene PubChem CID: 24820504 IUPAC Name: 2-bromo-3-fluorobenzaldehyde SMILES: C1=CC(=C(C(=C1)F)Br)C=O
| PubChem CID | 24820504 |
|---|---|
| CAS | 891180-59-9 |
| Molecular Weight (g/mol) | 203.01 |
| MDL Number | MFCD07782044 |
| SMILES | C1=CC(=C(C(=C1)F)Br)C=O |
| Synonym | 2-bromo-3-fluoro-benzaldehyde,benzaldehyde, 2-bromo-3-fluoro,pubchem1417,pubchem22500,acmc-1bwut,ksc494e8j,6-fluoro-2-formylbromobenzene |
| IUPAC Name | 2-bromo-3-fluorobenzaldehyde |
| InChI Key | CYJBMGYWRHGZBR-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrFO |
2-Fluorobenzaldehyde, 97%
CAS: 446-52-6 Molecular Formula: C7H5FO Molecular Weight (g/mol): 124.11 MDL Number: MFCD00003302 InChI Key: ZWDVQMVZZYIAHO-UHFFFAOYSA-N Synonym: o-fluorobenzaldehyde,benzaldehyde, 2-fluoro,benzaldehyde, o-fluoro,unii-7zx20dxb9z,2-fluor-benzaldehyd,2-fluoro-benzaldehyde,benzaldehyde, fluoro,ortho-fluorobenzaldehyde,7zx20dxb9z,fluorobenzaldehyde PubChem CID: 67970 IUPAC Name: 2-fluorobenzaldehyde SMILES: C1=CC=C(C(=C1)C=O)F
| PubChem CID | 67970 |
|---|---|
| CAS | 446-52-6 |
| Molecular Weight (g/mol) | 124.11 |
| MDL Number | MFCD00003302 |
| SMILES | C1=CC=C(C(=C1)C=O)F |
| Synonym | o-fluorobenzaldehyde,benzaldehyde, 2-fluoro,benzaldehyde, o-fluoro,unii-7zx20dxb9z,2-fluor-benzaldehyd,2-fluoro-benzaldehyde,benzaldehyde, fluoro,ortho-fluorobenzaldehyde,7zx20dxb9z,fluorobenzaldehyde |
| IUPAC Name | 2-fluorobenzaldehyde |
| InChI Key | ZWDVQMVZZYIAHO-UHFFFAOYSA-N |
| Molecular Formula | C7H5FO |
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
| 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 |
4'-n-Hexylbiphenyl-4-carboxylic acid, 99%
CAS: 59662-48-5 Molecular Formula: C19H22O2 Molecular Weight (g/mol): 282.38 MDL Number: MFCD00143232 InChI Key: ROJCBWVSXWIGAL-UHFFFAOYSA-N Synonym: 4-4-hexylphenyl benzoic acid,4-hexyl-4'-biphenylcarboxylic acid,4-hexyl-4'-carboxybiphenyl,4-n-hexylbiphenyl-4'-carboxylic acid,4'-hexyl-1,1'-biphenyl-4-carboxylic acid,pubchem9069,acmc-209mez,4'-hexylbiphenyl-4-carboxylic acid,4-hexylbiphenyl-4'-carboxylic acid,4'-hexyl-biphenyl-4-carboxylic acid PubChem CID: 13554588 IUPAC Name: 4'-hexyl-[1,1'-biphenyl]-4-carboxylic acid SMILES: CCCCCCC1=CC=C(C=C1)C1=CC=C(C=C1)C(O)=O
| PubChem CID | 13554588 |
|---|---|
| CAS | 59662-48-5 |
| Molecular Weight (g/mol) | 282.38 |
| MDL Number | MFCD00143232 |
| SMILES | CCCCCCC1=CC=C(C=C1)C1=CC=C(C=C1)C(O)=O |
| Synonym | 4-4-hexylphenyl benzoic acid,4-hexyl-4'-biphenylcarboxylic acid,4-hexyl-4'-carboxybiphenyl,4-n-hexylbiphenyl-4'-carboxylic acid,4'-hexyl-1,1'-biphenyl-4-carboxylic acid,pubchem9069,acmc-209mez,4'-hexylbiphenyl-4-carboxylic acid,4-hexylbiphenyl-4'-carboxylic acid,4'-hexyl-biphenyl-4-carboxylic acid |
| IUPAC Name | 4'-hexyl-[1,1'-biphenyl]-4-carboxylic acid |
| InChI Key | ROJCBWVSXWIGAL-UHFFFAOYSA-N |
| Molecular Formula | C19H22O2 |
n-Pentyl benzoate, 98+%
CAS: 2049-96-9 Molecular Formula: C12H16O2 Molecular Weight (g/mol): 192.258 MDL Number: MFCD00048843 InChI Key: QKNZNUNCDJZTCH-UHFFFAOYSA-N Synonym: amyl benzoate,n-pentyl benzoate,benzoic acid, pentyl ester,n-amyl benzoate,unii-cle7k4b29s,cle7k4b29s,amylbenzoat,amylbenzoate,n amyl benxoate,benzoic acid pentyl PubChem CID: 16296 IUPAC Name: pentyl benzoate SMILES: CCCCCOC(=O)C1=CC=CC=C1
| PubChem CID | 16296 |
|---|---|
| CAS | 2049-96-9 |
| Molecular Weight (g/mol) | 192.258 |
| MDL Number | MFCD00048843 |
| SMILES | CCCCCOC(=O)C1=CC=CC=C1 |
| Synonym | amyl benzoate,n-pentyl benzoate,benzoic acid, pentyl ester,n-amyl benzoate,unii-cle7k4b29s,cle7k4b29s,amylbenzoat,amylbenzoate,n amyl benxoate,benzoic acid pentyl |
| IUPAC Name | pentyl benzoate |
| InChI Key | QKNZNUNCDJZTCH-UHFFFAOYSA-N |
| Molecular Formula | C12H16O2 |
3,4,5-Trimethoxybenzaldehyde, 98%
CAS: 86-81-7 Molecular Formula: C10H12O4 Molecular Weight (g/mol): 196.202 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) | 196.202 |
| 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 |
2-Fluoro-6-methylbenzaldehyde, 97%
CAS: 117752-04-2 Molecular Formula: C8H7FO Molecular Weight (g/mol): 138.14 MDL Number: MFCD09258962 InChI Key: BGQBJWPZBBMKEI-UHFFFAOYSA-N PubChem CID: 14170517 IUPAC Name: 2-fluoro-6-methylbenzaldehyde SMILES: CC1=C(C=O)C(F)=CC=C1
| PubChem CID | 14170517 |
|---|---|
| CAS | 117752-04-2 |
| Molecular Weight (g/mol) | 138.14 |
| MDL Number | MFCD09258962 |
| SMILES | CC1=C(C=O)C(F)=CC=C1 |
| IUPAC Name | 2-fluoro-6-methylbenzaldehyde |
| InChI Key | BGQBJWPZBBMKEI-UHFFFAOYSA-N |
| Molecular Formula | C8H7FO |
2,5-Dimethylbenzaldehyde, 98%
CAS: 5779-94-2 Molecular Formula: C9H10O Molecular Weight (g/mol): 134.18 MDL Number: MFCD00003342 InChI Key: SMUVABOERCFKRW-UHFFFAOYSA-N PubChem CID: 22015 IUPAC Name: 2,5-dimethylbenzaldehyde SMILES: CC1=CC=C(C)C(C=O)=C1
| PubChem CID | 22015 |
|---|---|
| CAS | 5779-94-2 |
| Molecular Weight (g/mol) | 134.18 |
| MDL Number | MFCD00003342 |
| SMILES | CC1=CC=C(C)C(C=O)=C1 |
| IUPAC Name | 2,5-dimethylbenzaldehyde |
| InChI Key | SMUVABOERCFKRW-UHFFFAOYSA-N |
| Molecular Formula | C9H10O |
3-(1H-Tetrazol-5-yl)benzoic acid, 97%
CAS: 73096-39-6 Molecular Formula: C8H6N4O2 Molecular Weight (g/mol): 190.162 MDL Number: MFCD03821131 InChI Key: MIERACSHCALJOM-UHFFFAOYSA-N Synonym: 3-1h-tetrazol-5-yl benzoic acid,3-2h-tetrazol-5-yl benzoic acid,3-1h-tetrazol-5-yl-benzoic acid,3-2h-1,2,3,4-tetrazol-5-yl benzoic acid,benzoic acid, 3-1h-tetrazol-5-yl,3-1h-1,2,3,4-tetrazol-5-yl benzoic acid,3-2h-tetrazol-5-yl-benzoic acid,3-1h-1,2,3,4-tetraazol-5-yl benzoic acid,3-1h-tetrazol-5-yl benzoicacid,3-1h-tetrazole-5-yl benzoic acid PubChem CID: 333942 IUPAC Name: 3-(2H-tetrazol-5-yl)benzoic acid SMILES: C1=CC(=CC(=C1)C(=O)O)C2=NNN=N2
| PubChem CID | 333942 |
|---|---|
| CAS | 73096-39-6 |
| Molecular Weight (g/mol) | 190.162 |
| MDL Number | MFCD03821131 |
| SMILES | C1=CC(=CC(=C1)C(=O)O)C2=NNN=N2 |
| Synonym | 3-1h-tetrazol-5-yl benzoic acid,3-2h-tetrazol-5-yl benzoic acid,3-1h-tetrazol-5-yl-benzoic acid,3-2h-1,2,3,4-tetrazol-5-yl benzoic acid,benzoic acid, 3-1h-tetrazol-5-yl,3-1h-1,2,3,4-tetrazol-5-yl benzoic acid,3-2h-tetrazol-5-yl-benzoic acid,3-1h-1,2,3,4-tetraazol-5-yl benzoic acid,3-1h-tetrazol-5-yl benzoicacid,3-1h-tetrazole-5-yl benzoic acid |
| IUPAC Name | 3-(2H-tetrazol-5-yl)benzoic acid |
| InChI Key | MIERACSHCALJOM-UHFFFAOYSA-N |
| Molecular Formula | C8H6N4O2 |