Benzenoids
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3,5-Dinitrosalicylic Acid 98.0+%, TCI America™
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CAS: 609-99-4 Molecular Formula: C7H4N2O7 Molecular Weight (g/mol): 228.116 MDL Number: MFCD00007104 InChI Key: LWFUFLREGJMOIZ-UHFFFAOYSA-N Synonym: 3,5-dinitrosalicylic acid,2-hydroxy-3,5-dinitrobenzoic acid,3,5-dinitro-2-hydroxybenzoic acid,3,5-dinitrosalicylate,benzoic acid, 2-hydroxy-3,5-dinitro,salicylic acid, 3,5-dinitro,dnsa,o-dncp,o-dinitrocarboxylphenol,3,5-dinitro-2-salicylic acid PubChem CID: 11873 ChEBI: CHEBI:53648 SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])O)C(=O)O)[N+](=O)[O-]
| PubChem CID | 11873 |
|---|---|
| CAS | 609-99-4 |
| Molecular Weight (g/mol) | 228.116 |
| ChEBI | CHEBI:53648 |
| MDL Number | MFCD00007104 |
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])O)C(=O)O)[N+](=O)[O-] |
| Synonym | 3,5-dinitrosalicylic acid,2-hydroxy-3,5-dinitrobenzoic acid,3,5-dinitro-2-hydroxybenzoic acid,3,5-dinitrosalicylate,benzoic acid, 2-hydroxy-3,5-dinitro,salicylic acid, 3,5-dinitro,dnsa,o-dncp,o-dinitrocarboxylphenol,3,5-dinitro-2-salicylic acid |
| InChI Key | LWFUFLREGJMOIZ-UHFFFAOYSA-N |
| Molecular Formula | C7H4N2O7 |
4-Bromo-2-chlorobenzaldehyde 97.0+%, TCI America™
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CAS: 158435-41-7 Molecular Formula: C7H4BrClO Molecular Weight (g/mol): 219.46 MDL Number: MFCD08741413 InChI Key: DHGPLNJITGVCSG-UHFFFAOYSA-N PubChem CID: 14109109 IUPAC Name: 4-bromo-2-chlorobenzaldehyde SMILES: ClC1=C(C=O)C=CC(Br)=C1
| PubChem CID | 14109109 |
|---|---|
| CAS | 158435-41-7 |
| Molecular Weight (g/mol) | 219.46 |
| MDL Number | MFCD08741413 |
| SMILES | ClC1=C(C=O)C=CC(Br)=C1 |
| IUPAC Name | 4-bromo-2-chlorobenzaldehyde |
| InChI Key | DHGPLNJITGVCSG-UHFFFAOYSA-N |
| Molecular Formula | C7H4BrClO |
2,4,5-Trifluorobenzoyl Chloride 98.0+%, TCI America™
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CAS: 88419-56-1 Molecular Formula: C7H2ClF3O Molecular Weight (g/mol): 194.54 MDL Number: MFCD00061204 InChI Key: STBGCAUUOPNJBH-UHFFFAOYSA-N Synonym: 2,4,5-trifluorobenzoylchloride,benzoyl chloride, 2,4,5-trifluoro,2,4,5-tris fluoranyl benzoyl chloride,pubchem9716,acmc-209qt0,2,4,5-trifluorobenzoyl-chloride,stbgcauuopnjbh-uhfffaoysa,timtec-bb sbb006657,2,4,5-trifluoro-benzoyl chloride,2,4,5-trifluorobenzoyl chloride PubChem CID: 145164 IUPAC Name: 2,4,5-trifluorobenzoyl chloride SMILES: FC1=CC(F)=C(C=C1F)C(Cl)=O
| PubChem CID | 145164 |
|---|---|
| CAS | 88419-56-1 |
| Molecular Weight (g/mol) | 194.54 |
| MDL Number | MFCD00061204 |
| SMILES | FC1=CC(F)=C(C=C1F)C(Cl)=O |
| Synonym | 2,4,5-trifluorobenzoylchloride,benzoyl chloride, 2,4,5-trifluoro,2,4,5-tris fluoranyl benzoyl chloride,pubchem9716,acmc-209qt0,2,4,5-trifluorobenzoyl-chloride,stbgcauuopnjbh-uhfffaoysa,timtec-bb sbb006657,2,4,5-trifluoro-benzoyl chloride,2,4,5-trifluorobenzoyl chloride |
| IUPAC Name | 2,4,5-trifluorobenzoyl chloride |
| InChI Key | STBGCAUUOPNJBH-UHFFFAOYSA-N |
| Molecular Formula | C7H2ClF3O |
4-Iodo-3-nitrobenzoic Acid 97.0+%, TCI America™
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CAS: 35674-27-2 Molecular Formula: C7H4INO4 Molecular Weight (g/mol): 293.02 MDL Number: MFCD00502399 InChI Key: DNMTZLCNLAIKQC-UHFFFAOYSA-N Synonym: 4-iodo-3-nitrobenzoic acid,4-iodo-3-nitrobenzoicacid,3-nitro-4-iodobenzoic acid,4-iodo-3-nitro-benzoic acid,benzoic acid, 4-iodo-3-nitro,pubchem13471,acmc-209z8y,4-iodo-3-nitro benzoic acid PubChem CID: 11208598 IUPAC Name: 4-iodo-3-nitrobenzoic acid SMILES: OC(=O)C1=CC(=C(I)C=C1)[N+]([O-])=O
| PubChem CID | 11208598 |
|---|---|
| CAS | 35674-27-2 |
| Molecular Weight (g/mol) | 293.02 |
| MDL Number | MFCD00502399 |
| SMILES | OC(=O)C1=CC(=C(I)C=C1)[N+]([O-])=O |
| Synonym | 4-iodo-3-nitrobenzoic acid,4-iodo-3-nitrobenzoicacid,3-nitro-4-iodobenzoic acid,4-iodo-3-nitro-benzoic acid,benzoic acid, 4-iodo-3-nitro,pubchem13471,acmc-209z8y,4-iodo-3-nitro benzoic acid |
| IUPAC Name | 4-iodo-3-nitrobenzoic acid |
| InChI Key | DNMTZLCNLAIKQC-UHFFFAOYSA-N |
| Molecular Formula | C7H4INO4 |
3,5-Bis(4-nitrophenoxy)benzoic Acid 98.0+%, TCI America™
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CAS: 173550-33-9 Molecular Formula: C19H12N2O8 Molecular Weight (g/mol): 396.31 MDL Number: MFCD02093450 InChI Key: JOSXKPZXMVHRKU-UHFFFAOYSA-N Synonym: 3,5-bis 4-nitrophenoxy benzoic acid,gamma-secretase modulator, cw,cw,acmc-1cuip,josxkpzxmvhrku-uhfffaoysa PubChem CID: 16760376 IUPAC Name: 3,5-bis(4-nitrophenoxy)benzoic acid SMILES: OC(=O)C1=CC(OC2=CC=C(C=C2)[N+]([O-])=O)=CC(OC2=CC=C(C=C2)[N+]([O-])=O)=C1
| PubChem CID | 16760376 |
|---|---|
| CAS | 173550-33-9 |
| Molecular Weight (g/mol) | 396.31 |
| MDL Number | MFCD02093450 |
| SMILES | OC(=O)C1=CC(OC2=CC=C(C=C2)[N+]([O-])=O)=CC(OC2=CC=C(C=C2)[N+]([O-])=O)=C1 |
| Synonym | 3,5-bis 4-nitrophenoxy benzoic acid,gamma-secretase modulator, cw,cw,acmc-1cuip,josxkpzxmvhrku-uhfffaoysa |
| IUPAC Name | 3,5-bis(4-nitrophenoxy)benzoic acid |
| InChI Key | JOSXKPZXMVHRKU-UHFFFAOYSA-N |
| Molecular Formula | C19H12N2O8 |
2,6-Dinitro-p-cresol (wetted with ca. 20% Water) (unit weight on dry weight basis) 98.0+%, TCI America™
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CAS: 609-93-8 Molecular Formula: C7H6N2O5 Molecular Weight (g/mol): 198.13 MDL Number: MFCD00007121 InChI Key: HOYRZHJJAHRMLL-UHFFFAOYSA-N Synonym: 2,6-dinitro-p-cresol,4-methyl-2,6-dinitrophenol,victoria orange,victoria yellow,dinitro-p-cresol,2,6-dinitro-4-methylphenol,dnpc,phenol, 4-methyl-2,6-dinitro,p-cresol, 2,6-dinitro,unii-l572bvh6nf PubChem CID: 11872 IUPAC Name: 4-methyl-2,6-dinitrophenol SMILES: CC1=CC(=C(O)C(=C1)[N+]([O-])=O)[N+]([O-])=O
| PubChem CID | 11872 |
|---|---|
| CAS | 609-93-8 |
| Molecular Weight (g/mol) | 198.13 |
| MDL Number | MFCD00007121 |
| SMILES | CC1=CC(=C(O)C(=C1)[N+]([O-])=O)[N+]([O-])=O |
| Synonym | 2,6-dinitro-p-cresol,4-methyl-2,6-dinitrophenol,victoria orange,victoria yellow,dinitro-p-cresol,2,6-dinitro-4-methylphenol,dnpc,phenol, 4-methyl-2,6-dinitro,p-cresol, 2,6-dinitro,unii-l572bvh6nf |
| IUPAC Name | 4-methyl-2,6-dinitrophenol |
| InChI Key | HOYRZHJJAHRMLL-UHFFFAOYSA-N |
| Molecular Formula | C7H6N2O5 |
2-(Diphenylphosphino)benzonitrile 98.0+%, TCI America™
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CAS: 34825-99-5 Molecular Formula: C19H14NP Molecular Weight (g/mol): 287.302 MDL Number: MFCD05864011 InChI Key: FEOUZPAYKDNQBW-UHFFFAOYSA-N Synonym: (2-Cyanophenyl)diphenylphosphine PubChem CID: 4590862 IUPAC Name: 2-diphenylphosphanylbenzonitrile SMILES: C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3C#N
| PubChem CID | 4590862 |
|---|---|
| CAS | 34825-99-5 |
| Molecular Weight (g/mol) | 287.302 |
| MDL Number | MFCD05864011 |
| SMILES | C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3C#N |
| Synonym | (2-Cyanophenyl)diphenylphosphine |
| IUPAC Name | 2-diphenylphosphanylbenzonitrile |
| InChI Key | FEOUZPAYKDNQBW-UHFFFAOYSA-N |
| Molecular Formula | C19H14NP |
3-Amino-4-methoxybiphenyl 98.0+%, TCI America™
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CAS: 39811-17-1 Molecular Formula: C13H13NO Molecular Weight (g/mol): 199.253 MDL Number: MFCD00007790 InChI Key: DTYBRSLINXBXMP-UHFFFAOYSA-N Synonym: 5-phenyl-o-anisidine,3-amino-4-methoxybiphenyl,4-methoxy-1,1'-biphenyl-3-amine,2-amino-4-phenylanisole,4-methoxybiphenyl-3-amine,1,1'-biphenyl-3-amine, 4-methoxy,2-methoxy-5-phenylphenylamine,acmc-209j7y,2-methoxy-5-phenyl-aniline,3-amino-4-methoxy-biphenyl PubChem CID: 123489 IUPAC Name: 2-methoxy-5-phenylaniline SMILES: COC1=C(C=C(C=C1)C2=CC=CC=C2)N
| PubChem CID | 123489 |
|---|---|
| CAS | 39811-17-1 |
| Molecular Weight (g/mol) | 199.253 |
| MDL Number | MFCD00007790 |
| SMILES | COC1=C(C=C(C=C1)C2=CC=CC=C2)N |
| Synonym | 5-phenyl-o-anisidine,3-amino-4-methoxybiphenyl,4-methoxy-1,1'-biphenyl-3-amine,2-amino-4-phenylanisole,4-methoxybiphenyl-3-amine,1,1'-biphenyl-3-amine, 4-methoxy,2-methoxy-5-phenylphenylamine,acmc-209j7y,2-methoxy-5-phenyl-aniline,3-amino-4-methoxy-biphenyl |
| IUPAC Name | 2-methoxy-5-phenylaniline |
| InChI Key | DTYBRSLINXBXMP-UHFFFAOYSA-N |
| Molecular Formula | C13H13NO |
4-Aminostilbene 97.0+%, TCI America™
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CAS: 834-24-2 Molecular Formula: C14H13N Molecular Weight (g/mol): 195.27 MDL Number: MFCD00025377 InChI Key: VFPLSXYJYAKZCT-VOTSOKGWSA-N Synonym: 4-Stilbenamine PubChem CID: 1272788 IUPAC Name: 4-[(1E)-2-phenylethenyl]aniline SMILES: NC1=CC=C(\C=C\C2=CC=CC=C2)C=C1
| PubChem CID | 1272788 |
|---|---|
| CAS | 834-24-2 |
| Molecular Weight (g/mol) | 195.27 |
| MDL Number | MFCD00025377 |
| SMILES | NC1=CC=C(\C=C\C2=CC=CC=C2)C=C1 |
| Synonym | 4-Stilbenamine |
| IUPAC Name | 4-[(1E)-2-phenylethenyl]aniline |
| InChI Key | VFPLSXYJYAKZCT-VOTSOKGWSA-N |
| Molecular Formula | C14H13N |
5-Chloro-2,4-dimethoxyaniline 97.0+%, TCI America™
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3-Bromo-5-chlorobenzonitrile 98.0+%, TCI America™
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CAS: 304854-55-5 Molecular Formula: C7H3BrClN Molecular Weight (g/mol): 216.462 MDL Number: MFCD06200840 InChI Key: DRKWKPSNVQVDKZ-UHFFFAOYSA-N PubChem CID: 15965893 IUPAC Name: 3-bromo-5-chlorobenzonitrile SMILES: C1=C(C=C(C=C1Cl)Br)C#N
| PubChem CID | 15965893 |
|---|---|
| CAS | 304854-55-5 |
| Molecular Weight (g/mol) | 216.462 |
| MDL Number | MFCD06200840 |
| SMILES | C1=C(C=C(C=C1Cl)Br)C#N |
| IUPAC Name | 3-bromo-5-chlorobenzonitrile |
| InChI Key | DRKWKPSNVQVDKZ-UHFFFAOYSA-N |
| Molecular Formula | C7H3BrClN |
4-Bromo-3-fluoroanisole 98.0+%, TCI America™
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CAS: 458-50-4 Molecular Formula: C7H6BrFO Molecular Weight (g/mol): 205.026 MDL Number: MFCD01310983 InChI Key: XANVIFOBBVAKCY-UHFFFAOYSA-N Synonym: 4-bromo-3-fluoroanisole,3-fluoro-4-bromo anisole,3-fluoro-4-bromoanisol,3-fluoro-4-bromo anisol,1-bromo-2-fluoro-4-methoxy-benzene,benzene, 1-bromo-2-fluoro-4-methoxy,pharmabridge p-1018,rarechem al mz 0889,zlchem 365,pubchem1970 PubChem CID: 3718444 IUPAC Name: 1-bromo-2-fluoro-4-methoxybenzene SMILES: COC1=CC(=C(C=C1)Br)F
| PubChem CID | 3718444 |
|---|---|
| CAS | 458-50-4 |
| Molecular Weight (g/mol) | 205.026 |
| MDL Number | MFCD01310983 |
| SMILES | COC1=CC(=C(C=C1)Br)F |
| Synonym | 4-bromo-3-fluoroanisole,3-fluoro-4-bromo anisole,3-fluoro-4-bromoanisol,3-fluoro-4-bromo anisol,1-bromo-2-fluoro-4-methoxy-benzene,benzene, 1-bromo-2-fluoro-4-methoxy,pharmabridge p-1018,rarechem al mz 0889,zlchem 365,pubchem1970 |
| IUPAC Name | 1-bromo-2-fluoro-4-methoxybenzene |
| InChI Key | XANVIFOBBVAKCY-UHFFFAOYSA-N |
| Molecular Formula | C7H6BrFO |
4-Fluorohippuric Acid 98.0+%, TCI America™
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CAS: 366-79-0 Molecular Formula: C9H7FNO3 Molecular Weight (g/mol): 196.16 MDL Number: MFCD00462263 InChI Key: NVWXSGQHHUSSOU-UHFFFAOYSA-M Synonym: N-(4-Fluorobenzoyl)glycine, 2-(4-Fluorobenzamido)acetic Acid PubChem CID: 699341 IUPAC Name: 2-[(4-fluorophenyl)formamido]acetate SMILES: [O-]C(=O)CNC(=O)C1=CC=C(F)C=C1
| PubChem CID | 699341 |
|---|---|
| CAS | 366-79-0 |
| Molecular Weight (g/mol) | 196.16 |
| MDL Number | MFCD00462263 |
| SMILES | [O-]C(=O)CNC(=O)C1=CC=C(F)C=C1 |
| Synonym | N-(4-Fluorobenzoyl)glycine, 2-(4-Fluorobenzamido)acetic Acid |
| IUPAC Name | 2-[(4-fluorophenyl)formamido]acetate |
| InChI Key | NVWXSGQHHUSSOU-UHFFFAOYSA-M |
| Molecular Formula | C9H7FNO3 |
4-Amino-2-chlorophenol 98.0+%, TCI America™
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CAS: 3964-52-1 Molecular Formula: C6H6ClNO Molecular Weight (g/mol): 143.57 MDL Number: MFCD00128891 InChI Key: ZYZQSCWSPFLAFM-UHFFFAOYSA-N Synonym: 3-chloro-4-hydroxyaniline,2-chloro-4-aminophenol,phenol, 4-amino-2-chloro,4-amino-2-chloro-phenol,unii-2z6zt3b98u,o-chloro-p-aminophenol,pubchem18907,salzsaurem p-aminophenol,acmc-1aiqv,3-chloro4-hydroxyaniline PubChem CID: 77578 IUPAC Name: 4-amino-2-chlorophenol SMILES: NC1=CC=C(O)C(Cl)=C1
| PubChem CID | 77578 |
|---|---|
| CAS | 3964-52-1 |
| Molecular Weight (g/mol) | 143.57 |
| MDL Number | MFCD00128891 |
| SMILES | NC1=CC=C(O)C(Cl)=C1 |
| Synonym | 3-chloro-4-hydroxyaniline,2-chloro-4-aminophenol,phenol, 4-amino-2-chloro,4-amino-2-chloro-phenol,unii-2z6zt3b98u,o-chloro-p-aminophenol,pubchem18907,salzsaurem p-aminophenol,acmc-1aiqv,3-chloro4-hydroxyaniline |
| IUPAC Name | 4-amino-2-chlorophenol |
| InChI Key | ZYZQSCWSPFLAFM-UHFFFAOYSA-N |
| Molecular Formula | C6H6ClNO |
2-Bromo-4-chloro-6-fluoroaniline 98.0+%, TCI America™
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CAS: 195191-47-0 Molecular Formula: C6H4BrClFN Molecular Weight (g/mol): 224.46 MDL Number: MFCD00070746 InChI Key: HBHBARSMRVAINH-UHFFFAOYSA-N Synonym: 6-bromo-4-chloro-2-fluoroaniline,2-amino-1-bromo-5-chloro-3-fluorobenzene,2-fluoro-4-chloro-6-bromoaniline,benzenamine, 2-bromo-4-chloro-6-fluoro,pubchem2916,acmc-1cbvw,2-bromo-4-chloro-6-fluoro-aniline,2-fluoro-4-chloro-6-bromo aniline,2-bromo-4-chloro-6-fluorobenzenamine,2-bromo-4-chloro-6-fluorophenylamine PubChem CID: 2736222 IUPAC Name: 2-bromo-4-chloro-6-fluoroaniline SMILES: NC1=C(Br)C=C(Cl)C=C1F
| PubChem CID | 2736222 |
|---|---|
| CAS | 195191-47-0 |
| Molecular Weight (g/mol) | 224.46 |
| MDL Number | MFCD00070746 |
| SMILES | NC1=C(Br)C=C(Cl)C=C1F |
| Synonym | 6-bromo-4-chloro-2-fluoroaniline,2-amino-1-bromo-5-chloro-3-fluorobenzene,2-fluoro-4-chloro-6-bromoaniline,benzenamine, 2-bromo-4-chloro-6-fluoro,pubchem2916,acmc-1cbvw,2-bromo-4-chloro-6-fluoro-aniline,2-fluoro-4-chloro-6-bromo aniline,2-bromo-4-chloro-6-fluorobenzenamine,2-bromo-4-chloro-6-fluorophenylamine |
| IUPAC Name | 2-bromo-4-chloro-6-fluoroaniline |
| InChI Key | HBHBARSMRVAINH-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrClFN |