Benzenoids
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2-Aminoterephthalic Acid 98.0+%, TCI America™
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CAS: 10312-55-7 Molecular Formula: C8H5NO4 Molecular Weight (g/mol): 179.13 MDL Number: MFCD00134536 InChI Key: GPNNOCMCNFXRAO-UHFFFAOYSA-L Synonym: aminoterephthalic acid,2-aminobenzene-1,4-dicarboxylic acid,2-amino-1,4-benzenedicarboxylic acid,4-carboxyanthranilic acid,1,4-benzenedicarboxylic acid, 2-amino,2-aminoterephthalic,aminoterephthalicacid,2,5-dicarboxyaniline,2-aminoterephtalic acid,timtec-bb sbb006751 PubChem CID: 2724822 IUPAC Name: 2-aminobenzene-1,4-dicarboxylate SMILES: NC1=CC(=CC=C1C([O-])=O)C([O-])=O
| PubChem CID | 2724822 |
|---|---|
| CAS | 10312-55-7 |
| Molecular Weight (g/mol) | 179.13 |
| MDL Number | MFCD00134536 |
| SMILES | NC1=CC(=CC=C1C([O-])=O)C([O-])=O |
| Synonym | aminoterephthalic acid,2-aminobenzene-1,4-dicarboxylic acid,2-amino-1,4-benzenedicarboxylic acid,4-carboxyanthranilic acid,1,4-benzenedicarboxylic acid, 2-amino,2-aminoterephthalic,aminoterephthalicacid,2,5-dicarboxyaniline,2-aminoterephtalic acid,timtec-bb sbb006751 |
| IUPAC Name | 2-aminobenzene-1,4-dicarboxylate |
| InChI Key | GPNNOCMCNFXRAO-UHFFFAOYSA-L |
| Molecular Formula | C8H5NO4 |
2-Chloroanisole 98.0+%, TCI America™
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CAS: 766-51-8 Molecular Formula: C7H7ClO Molecular Weight (g/mol): 142.582 MDL Number: MFCD00000557 InChI Key: QGRPVMLBTFGQDQ-UHFFFAOYSA-N Synonym: 2-chloroanisole,o-chloroanisole,benzene, 1-chloro-2-methoxy,anisole, o-chloro,o-chloromethoxybenzene,o-chlorophenyl methyl ether,2-chlorophenol methyl ether,chloroanisole,1-chloro-2-methoxy-benzene,labotest-bb ltbb002921 PubChem CID: 13011 IUPAC Name: 1-chloro-2-methoxybenzene SMILES: COC1=CC=CC=C1Cl
| PubChem CID | 13011 |
|---|---|
| CAS | 766-51-8 |
| Molecular Weight (g/mol) | 142.582 |
| MDL Number | MFCD00000557 |
| SMILES | COC1=CC=CC=C1Cl |
| Synonym | 2-chloroanisole,o-chloroanisole,benzene, 1-chloro-2-methoxy,anisole, o-chloro,o-chloromethoxybenzene,o-chlorophenyl methyl ether,2-chlorophenol methyl ether,chloroanisole,1-chloro-2-methoxy-benzene,labotest-bb ltbb002921 |
| IUPAC Name | 1-chloro-2-methoxybenzene |
| InChI Key | QGRPVMLBTFGQDQ-UHFFFAOYSA-N |
| Molecular Formula | C7H7ClO |
(S)-(-)-N-(alpha-Methylbenzyl)phthalamic Acid 98.0+%, TCI America™
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CAS: 21752-36-3 Molecular Formula: C16H15NO3 Molecular Weight (g/mol): 269.3 MDL Number: MFCD00013979 InChI Key: VCFKXWGKKDZMPO-NSHDSACASA-N Synonym: s-2-1-phenylethyl carbamoyl benzoic acid,s---n-alpha-methylbenzyl phthalamic acid,s---n-1-phenylethyl phthalamic acid,2-1s-1-phenylethyl carbamoyl benzoic acid,s-o-1-phenylethyl amino carbonyl benzoic acid,benzoic acid,2-1s-1-phenylethyl amino carbonyl,s---n-alpha-methylbenzyl phthalamicacid,s---n-,a-methylbenzyl phthalamic acid,s---n-a-methylbenzyl phthalamidic acid PubChem CID: 89037 IUPAC Name: 2-[[(1S)-1-phenylethyl]carbamoyl]benzoic acid SMILES: CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2C(=O)O
| PubChem CID | 89037 |
|---|---|
| CAS | 21752-36-3 |
| Molecular Weight (g/mol) | 269.3 |
| MDL Number | MFCD00013979 |
| SMILES | CC(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2C(=O)O |
| Synonym | s-2-1-phenylethyl carbamoyl benzoic acid,s---n-alpha-methylbenzyl phthalamic acid,s---n-1-phenylethyl phthalamic acid,2-1s-1-phenylethyl carbamoyl benzoic acid,s-o-1-phenylethyl amino carbonyl benzoic acid,benzoic acid,2-1s-1-phenylethyl amino carbonyl,s---n-alpha-methylbenzyl phthalamicacid,s---n-,a-methylbenzyl phthalamic acid,s---n-a-methylbenzyl phthalamidic acid |
| IUPAC Name | 2-[[(1S)-1-phenylethyl]carbamoyl]benzoic acid |
| InChI Key | VCFKXWGKKDZMPO-NSHDSACASA-N |
| Molecular Formula | C16H15NO3 |
2-Bromophenylacetic Acid 98.0+%, TCI America™
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CAS: 18698-97-0 Molecular Formula: C8H7BrO2 Molecular Weight (g/mol): 215.046 MDL Number: MFCD00004314 InChI Key: DWXSYDKEWORWBT-UHFFFAOYSA-N Synonym: 2-bromophenylacetic acid,2-2-bromophenyl acetic acid,o-bromophenylacetic acid,2-bromophenyl acetic acid,benzeneacetic acid, 2-bromo,2-bromophenylaceticacid,2-bromo-phenyl-acetic acid,pubchem7214,acmc-1btqg PubChem CID: 87754 IUPAC Name: 2-(2-bromophenyl)acetic acid SMILES: C1=CC=C(C(=C1)CC(=O)O)Br
| PubChem CID | 87754 |
|---|---|
| CAS | 18698-97-0 |
| Molecular Weight (g/mol) | 215.046 |
| MDL Number | MFCD00004314 |
| SMILES | C1=CC=C(C(=C1)CC(=O)O)Br |
| Synonym | 2-bromophenylacetic acid,2-2-bromophenyl acetic acid,o-bromophenylacetic acid,2-bromophenyl acetic acid,benzeneacetic acid, 2-bromo,2-bromophenylaceticacid,2-bromo-phenyl-acetic acid,pubchem7214,acmc-1btqg |
| IUPAC Name | 2-(2-bromophenyl)acetic acid |
| InChI Key | DWXSYDKEWORWBT-UHFFFAOYSA-N |
| Molecular Formula | C8H7BrO2 |
Trityl Bromide 98.0+%, TCI America™
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CAS: 596-43-0 Molecular Formula: C19H15Br Molecular Weight (g/mol): 323.233 MDL Number: MFCD00000120 InChI Key: NZHXEWZGTQSYJM-UHFFFAOYSA-N Synonym: bromotriphenylmethane,triphenylmethyl bromide,trityl bromide,triphenylbromomethane,bromodiphenylmethyl benzene,methane, bromotriphenyl,benzene, 1,1',1-bromomethylidyne tris,triphenylmethylbromide,bromomethanetriyl tribenzene,2-bromo-1,1,1-triphenylethane PubChem CID: 11692 IUPAC Name: [bromo(diphenyl)methyl]benzene SMILES: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)Br
| PubChem CID | 11692 |
|---|---|
| CAS | 596-43-0 |
| Molecular Weight (g/mol) | 323.233 |
| MDL Number | MFCD00000120 |
| SMILES | C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)Br |
| Synonym | bromotriphenylmethane,triphenylmethyl bromide,trityl bromide,triphenylbromomethane,bromodiphenylmethyl benzene,methane, bromotriphenyl,benzene, 1,1',1-bromomethylidyne tris,triphenylmethylbromide,bromomethanetriyl tribenzene,2-bromo-1,1,1-triphenylethane |
| IUPAC Name | [bromo(diphenyl)methyl]benzene |
| InChI Key | NZHXEWZGTQSYJM-UHFFFAOYSA-N |
| Molecular Formula | C19H15Br |
3-(2-Fluorophenoxy)benzyl Bromide, TCI America™
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CAS: 242812-04-0 Molecular Formula: C13H10BrFO Molecular Weight (g/mol): 281.124 MDL Number: MFCD00059914 InChI Key: FWAHWPGVFDHNCH-UHFFFAOYSA-N Synonym: 3′C-Bromomethyl-2-fluorodiphenyl Ether PubChem CID: 2737454 IUPAC Name: 1-(bromomethyl)-3-(2-fluorophenoxy)benzene SMILES: C1=CC=C(C(=C1)OC2=CC=CC(=C2)CBr)F
| PubChem CID | 2737454 |
|---|---|
| CAS | 242812-04-0 |
| Molecular Weight (g/mol) | 281.124 |
| MDL Number | MFCD00059914 |
| SMILES | C1=CC=C(C(=C1)OC2=CC=CC(=C2)CBr)F |
| Synonym | 3′C-Bromomethyl-2-fluorodiphenyl Ether |
| IUPAC Name | 1-(bromomethyl)-3-(2-fluorophenoxy)benzene |
| InChI Key | FWAHWPGVFDHNCH-UHFFFAOYSA-N |
| Molecular Formula | C13H10BrFO |
Chloro[1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene]copper(I) 98.0+%, TCI America™
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CAS: 578743-87-0 Molecular Formula: C27H36ClCuN2 MDL Number: MFCD09264276
| CAS | 578743-87-0 |
|---|---|
| MDL Number | MFCD09264276 |
| Molecular Formula | C27H36ClCuN2 |
4-Nitrocatechol 98.0+%, TCI America™
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CAS: 3316-09-4 Molecular Formula: C6H5NO4 Molecular Weight (g/mol): 155.11 MDL Number: MFCD00007242 InChI Key: XJNPNXSISMKQEX-UHFFFAOYSA-N Synonym: 4-nitrocatechol,4-nitropyrocatechol,1,2-dihydroxy-4-nitrobenzene,4-nitro-1,2-benzenediol,3,4-dihydroxy-1-nitrobenzene,unii-sw60ng75en,sw60ng75en,1,2-benzenediol, 4-nitro,nitrocatechol mix of isomers,4nc PubChem CID: 3505109 ChEBI: CHEBI:16318 IUPAC Name: 4-nitrobenzene-1,2-diol SMILES: C1=CC(=C(C=C1[N+](=O)[O-])O)O
| PubChem CID | 3505109 |
|---|---|
| CAS | 3316-09-4 |
| Molecular Weight (g/mol) | 155.11 |
| ChEBI | CHEBI:16318 |
| MDL Number | MFCD00007242 |
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])O)O |
| Synonym | 4-nitrocatechol,4-nitropyrocatechol,1,2-dihydroxy-4-nitrobenzene,4-nitro-1,2-benzenediol,3,4-dihydroxy-1-nitrobenzene,unii-sw60ng75en,sw60ng75en,1,2-benzenediol, 4-nitro,nitrocatechol mix of isomers,4nc |
| IUPAC Name | 4-nitrobenzene-1,2-diol |
| InChI Key | XJNPNXSISMKQEX-UHFFFAOYSA-N |
| Molecular Formula | C6H5NO4 |
4-tert-Butylpyrocatechol 98.0+%, TCI America™
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CAS: 98-29-3 Molecular Formula: C10H14O2 Molecular Weight (g/mol): 166.22 MDL Number: MFCD00002201 InChI Key: XESZUVZBAMCAEJ-UHFFFAOYSA-N Synonym: 4-tert-butylcatechol,p-tert-butylcatechol,4-tert-butylpyrocatechol,p-tert-butyl catechol,4-tert-butyl benzene-1,2-diol,4-t-butylpyrocatechol,p-tert-butylpyrocatechol,4-t-butylcatechol,1,2-benzenediol, 4-1,1-dimethylethyl,4-tert-butylcatechin PubChem CID: 7381 IUPAC Name: 4-tert-butylbenzene-1,2-diol SMILES: CC(C)(C)C1=CC=C(O)C(O)=C1
| PubChem CID | 7381 |
|---|---|
| CAS | 98-29-3 |
| Molecular Weight (g/mol) | 166.22 |
| MDL Number | MFCD00002201 |
| SMILES | CC(C)(C)C1=CC=C(O)C(O)=C1 |
| Synonym | 4-tert-butylcatechol,p-tert-butylcatechol,4-tert-butylpyrocatechol,p-tert-butyl catechol,4-tert-butyl benzene-1,2-diol,4-t-butylpyrocatechol,p-tert-butylpyrocatechol,4-t-butylcatechol,1,2-benzenediol, 4-1,1-dimethylethyl,4-tert-butylcatechin |
| IUPAC Name | 4-tert-butylbenzene-1,2-diol |
| InChI Key | XESZUVZBAMCAEJ-UHFFFAOYSA-N |
| Molecular Formula | C10H14O2 |
3-Fluoroaniline 98.0+%, TCI America™
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CAS: 372-19-0 Molecular Formula: C6H6FN Molecular Weight (g/mol): 111.119 MDL Number: MFCD00007758 InChI Key: QZVQQUVWFIZUBQ-UHFFFAOYSA-N Synonym: m-fluoroaniline,1-amino-3-fluorobenzene,3-fluoranilin,benzenamine, 3-fluoro,3-fluorobenzenamine,3-fluoro-phenylamine,aniline, 3-fluoro,3-fluorophenylamine,aniline, m-fluoro,3-fluoranilin czech PubChem CID: 9742 ChEBI: CHEBI:27873 IUPAC Name: 3-fluoroaniline SMILES: C1=CC(=CC(=C1)F)N
| PubChem CID | 9742 |
|---|---|
| CAS | 372-19-0 |
| Molecular Weight (g/mol) | 111.119 |
| ChEBI | CHEBI:27873 |
| MDL Number | MFCD00007758 |
| SMILES | C1=CC(=CC(=C1)F)N |
| Synonym | m-fluoroaniline,1-amino-3-fluorobenzene,3-fluoranilin,benzenamine, 3-fluoro,3-fluorobenzenamine,3-fluoro-phenylamine,aniline, 3-fluoro,3-fluorophenylamine,aniline, m-fluoro,3-fluoranilin czech |
| IUPAC Name | 3-fluoroaniline |
| InChI Key | QZVQQUVWFIZUBQ-UHFFFAOYSA-N |
| Molecular Formula | C6H6FN |
1-Bromo-4-decylbenzene 88.0+%, TCI America™
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CAS: 106418-67-1 Molecular Formula: C16H25Br Molecular Weight (g/mol): 297.28 MDL Number: MFCD00061112 InChI Key: SWTGVSCSSDYINB-UHFFFAOYSA-N Synonym: 1-bromo-4-n-decylbenzene,benzene, 1-bromo-4-decyl,4-decylbromobenzene,acmc-2098jm,ksc909c2n PubChem CID: 13757384 IUPAC Name: 1-bromo-4-decylbenzene SMILES: CCCCCCCCCCC1=CC=C(Br)C=C1
| PubChem CID | 13757384 |
|---|---|
| CAS | 106418-67-1 |
| Molecular Weight (g/mol) | 297.28 |
| MDL Number | MFCD00061112 |
| SMILES | CCCCCCCCCCC1=CC=C(Br)C=C1 |
| Synonym | 1-bromo-4-n-decylbenzene,benzene, 1-bromo-4-decyl,4-decylbromobenzene,acmc-2098jm,ksc909c2n |
| IUPAC Name | 1-bromo-4-decylbenzene |
| InChI Key | SWTGVSCSSDYINB-UHFFFAOYSA-N |
| Molecular Formula | C16H25Br |
Leucoquinizarin 98.0+%, TCI America™
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CAS: 476-60-8 Molecular Formula: C14H10O4 Molecular Weight (g/mol): 242.23 MDL Number: MFCD00058948 InChI Key: BKNBVEKCHVXGPH-UHFFFAOYSA-N Synonym: 2,3-Dihydro-9,10-dihydroxy-1,4-anthraquinone, 1,4-Dihydroxyanthrahydroquinone, leuco-Quinizarin, 1,4,9,10-Tetrahydroxyanthracene PubChem CID: 68063 IUPAC Name: anthracene-1,4,9,10-tetrol SMILES: OC1=C2C(O)=C3C=CC=CC3=C(O)C2=C(O)C=C1
| PubChem CID | 68063 |
|---|---|
| CAS | 476-60-8 |
| Molecular Weight (g/mol) | 242.23 |
| MDL Number | MFCD00058948 |
| SMILES | OC1=C2C(O)=C3C=CC=CC3=C(O)C2=C(O)C=C1 |
| Synonym | 2,3-Dihydro-9,10-dihydroxy-1,4-anthraquinone, 1,4-Dihydroxyanthrahydroquinone, leuco-Quinizarin, 1,4,9,10-Tetrahydroxyanthracene |
| IUPAC Name | anthracene-1,4,9,10-tetrol |
| InChI Key | BKNBVEKCHVXGPH-UHFFFAOYSA-N |
| Molecular Formula | C14H10O4 |
4-Bromo-2-fluorobenzotrifluoride 98.0+%, TCI America™
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CAS: 142808-15-9 Molecular Formula: C7H3BrF4 Molecular Weight (g/mol): 243.00 MDL Number: MFCD01075254 InChI Key: OEPBVXQEVBURGC-UHFFFAOYSA-N Synonym: 4-bromo-2-fluorobenzotrifluoride,4-bromo-2-fluoro-1-trifluoromethyl benzene,2-fluoro-4-bromobenzotrifluoride,1-bromo-3-fluoro-4-trifluoromethyl benzene,benzene, 4-bromo-2-fluoro-1-trifluoromethyl,2-fluoro-4-bromotrifluorotoluene,3-fluoro-4-trifluoromethyl bromobenzene,4-bromo-alpha,alpha,alpha,2-tetrafluorotoluene,4-bromo-2-fluoro benzotrifluoride,4-bromo-2-fluoro-1-trifluoromethyl-benzene PubChem CID: 2782904 IUPAC Name: 4-bromo-2-fluoro-1-(trifluoromethyl)benzene SMILES: FC1=C(C=CC(Br)=C1)C(F)(F)F
| PubChem CID | 2782904 |
|---|---|
| CAS | 142808-15-9 |
| Molecular Weight (g/mol) | 243.00 |
| MDL Number | MFCD01075254 |
| SMILES | FC1=C(C=CC(Br)=C1)C(F)(F)F |
| Synonym | 4-bromo-2-fluorobenzotrifluoride,4-bromo-2-fluoro-1-trifluoromethyl benzene,2-fluoro-4-bromobenzotrifluoride,1-bromo-3-fluoro-4-trifluoromethyl benzene,benzene, 4-bromo-2-fluoro-1-trifluoromethyl,2-fluoro-4-bromotrifluorotoluene,3-fluoro-4-trifluoromethyl bromobenzene,4-bromo-alpha,alpha,alpha,2-tetrafluorotoluene,4-bromo-2-fluoro benzotrifluoride,4-bromo-2-fluoro-1-trifluoromethyl-benzene |
| IUPAC Name | 4-bromo-2-fluoro-1-(trifluoromethyl)benzene |
| InChI Key | OEPBVXQEVBURGC-UHFFFAOYSA-N |
| Molecular Formula | C7H3BrF4 |
Methyl 2-Nitrobenzoate 98.0+%, TCI America™
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CAS: 606-27-9 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00007136 InChI Key: AOXPHVNMBPFOFS-UHFFFAOYSA-N Synonym: methyl o-nitrobenzoate,benzoic acid, 2-nitro-, methyl ester,2-nitro-benzoic acid methyl ester,benzoic acid, o-nitro-, methyl ester,2-nitrobenzoic acid methyl ester,methyl-2-nitrobenzoate,methyl o-nitro benzoate,methyl ortho-nitrobenzoate,acmc-209ml4,nitrobenzoic acid methyl ester PubChem CID: 69072 IUPAC Name: methyl 2-nitrobenzoate SMILES: COC(=O)C1=CC=CC=C1[N+](=O)[O-]
| PubChem CID | 69072 |
|---|---|
| CAS | 606-27-9 |
| Molecular Weight (g/mol) | 181.147 |
| MDL Number | MFCD00007136 |
| SMILES | COC(=O)C1=CC=CC=C1[N+](=O)[O-] |
| Synonym | methyl o-nitrobenzoate,benzoic acid, 2-nitro-, methyl ester,2-nitro-benzoic acid methyl ester,benzoic acid, o-nitro-, methyl ester,2-nitrobenzoic acid methyl ester,methyl-2-nitrobenzoate,methyl o-nitro benzoate,methyl ortho-nitrobenzoate,acmc-209ml4,nitrobenzoic acid methyl ester |
| IUPAC Name | methyl 2-nitrobenzoate |
| InChI Key | AOXPHVNMBPFOFS-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO4 |
Nalpha-[(9H-Fluoren-9-ylmethoxy)carbonyl]-D-lysine Hydrochloride 98.0+%, TCI America™
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CAS: 201002-47-3 Molecular Formula: C21H25ClN2O4 Molecular Weight (g/mol): 404.891 MDL Number: MFCD00190888 InChI Key: MVMZFAIUUXYFGY-FSRHSHDFSA-N Synonym: Nalpha-Fmoc-D-lysine Hydrochloride, Fmoc-D-Lys-OH.HCl PubChem CID: 44629939 IUPAC Name: (2R)-6-amino-2-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoic acid;hydrochloride SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CCCCN)C(=O)O.Cl
| PubChem CID | 44629939 |
|---|---|
| CAS | 201002-47-3 |
| Molecular Weight (g/mol) | 404.891 |
| MDL Number | MFCD00190888 |
| SMILES | C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CCCCN)C(=O)O.Cl |
| Synonym | Nalpha-Fmoc-D-lysine Hydrochloride, Fmoc-D-Lys-OH.HCl |
| IUPAC Name | (2R)-6-amino-2-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoic acid;hydrochloride |
| InChI Key | MVMZFAIUUXYFGY-FSRHSHDFSA-N |
| Molecular Formula | C21H25ClN2O4 |