Benzenoids
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4-(2-Methoxyethyl)phenol 98.0+%, TCI America™
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CAS: 56718-71-9 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.193 MDL Number: MFCD00017537 InChI Key: FAYGEALAEQKPDI-UHFFFAOYSA-N Synonym: 4-2-methoxyethyl phenol,p-2-methoxyethyl phenol,phenol, 4-2-methoxyethyl,4-methoxyethylphenol,unii-py1w0akw8i,metoprolol impurity b,metoprolol impurity i,py1w0akw8i,4-hydroxyphenylethyl methyl ether PubChem CID: 92516 IUPAC Name: 4-(2-methoxyethyl)phenol SMILES: COCCC1=CC=C(C=C1)O
| PubChem CID | 92516 |
|---|---|
| CAS | 56718-71-9 |
| Molecular Weight (g/mol) | 152.193 |
| MDL Number | MFCD00017537 |
| SMILES | COCCC1=CC=C(C=C1)O |
| Synonym | 4-2-methoxyethyl phenol,p-2-methoxyethyl phenol,phenol, 4-2-methoxyethyl,4-methoxyethylphenol,unii-py1w0akw8i,metoprolol impurity b,metoprolol impurity i,py1w0akw8i,4-hydroxyphenylethyl methyl ether |
| IUPAC Name | 4-(2-methoxyethyl)phenol |
| InChI Key | FAYGEALAEQKPDI-UHFFFAOYSA-N |
| Molecular Formula | C9H12O2 |
4-Chlororesorcinol 98.0+%, TCI America™
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CAS: 95-88-5 Molecular Formula: C6H5ClO2 Molecular Weight (g/mol): 144.55 MDL Number: MFCD00002273 InChI Key: JQVAPEJNIZULEK-UHFFFAOYSA-N Synonym: 4-chlororesorcinol,1,3-benzenediol, 4-chloro,p-chlororesorcinol,4-chlororesorcin,resorcinol, 4-chloro,6-chlororesorcinol,4-chloro-1,3-dihydroxybenzene,4-chloro-1,3-benzenediol,2,4-dihydroxychlorobenzene,1,3-dihydroxy-4-chlorobenzene PubChem CID: 1731 IUPAC Name: 4-chlorobenzene-1,3-diol SMILES: OC1=CC=C(Cl)C(O)=C1
| PubChem CID | 1731 |
|---|---|
| CAS | 95-88-5 |
| Molecular Weight (g/mol) | 144.55 |
| MDL Number | MFCD00002273 |
| SMILES | OC1=CC=C(Cl)C(O)=C1 |
| Synonym | 4-chlororesorcinol,1,3-benzenediol, 4-chloro,p-chlororesorcinol,4-chlororesorcin,resorcinol, 4-chloro,6-chlororesorcinol,4-chloro-1,3-dihydroxybenzene,4-chloro-1,3-benzenediol,2,4-dihydroxychlorobenzene,1,3-dihydroxy-4-chlorobenzene |
| IUPAC Name | 4-chlorobenzene-1,3-diol |
| InChI Key | JQVAPEJNIZULEK-UHFFFAOYSA-N |
| Molecular Formula | C6H5ClO2 |
Nalpha-[(9H-Fluoren-9-ylmethoxy)carbonyl]-O-tert-butyl-L-threonine 98.0+%, TCI America™
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CAS: 71989-35-0 Molecular Formula: C23H27NO5 Molecular Weight (g/mol): 397.47 MDL Number: MFCD00077075 InChI Key: LZOLWEQBVPVDPR-VLIAUNLRSA-N Synonym: fmoc-thr tbu-oh,fmoc-o-tert-butyl-l-threonine,fmoc-thr t-bu-oh,n-9-fluorenylmethoxycarbonyl-o-tert-butyl-l-threonine,fmoc-thr but,2s,3r-3-tert-butoxy-2-9h-fluoren-9-ylmethoxy carbonyl amino butanoic acid,n-9h-fluoren-9-yl methoxy carbonyl-o-tert-butyl-l-threonine,fmoc-thr but-oh,fmoc-o-tert.butyl-l-threonine,fmoc-thr otbu-oh PubChem CID: 6364643 IUPAC Name: (2S,3R)-3-(tert-butoxy)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanoic acid SMILES: C[C@@H](OC(C)(C)C)[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(O)=O
| PubChem CID | 6364643 |
|---|---|
| CAS | 71989-35-0 |
| Molecular Weight (g/mol) | 397.47 |
| MDL Number | MFCD00077075 |
| SMILES | C[C@@H](OC(C)(C)C)[C@H](NC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(O)=O |
| Synonym | fmoc-thr tbu-oh,fmoc-o-tert-butyl-l-threonine,fmoc-thr t-bu-oh,n-9-fluorenylmethoxycarbonyl-o-tert-butyl-l-threonine,fmoc-thr but,2s,3r-3-tert-butoxy-2-9h-fluoren-9-ylmethoxy carbonyl amino butanoic acid,n-9h-fluoren-9-yl methoxy carbonyl-o-tert-butyl-l-threonine,fmoc-thr but-oh,fmoc-o-tert.butyl-l-threonine,fmoc-thr otbu-oh |
| IUPAC Name | (2S,3R)-3-(tert-butoxy)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanoic acid |
| InChI Key | LZOLWEQBVPVDPR-VLIAUNLRSA-N |
| Molecular Formula | C23H27NO5 |
2'-Methyl-3'-nitroacetanilide 98.0+%, TCI America™
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CAS: 56207-36-4 Molecular Formula: C9H10N2O3 Molecular Weight (g/mol): 194.19 MDL Number: MFCD01047363 InChI Key: NMYFXIITWKKOKY-UHFFFAOYSA-N PubChem CID: 151316 IUPAC Name: N-(2-methyl-3-nitrophenyl)acetamide SMILES: CC(=O)NC1=CC=CC(=C1C)[N+]([O-])=O
| PubChem CID | 151316 |
|---|---|
| CAS | 56207-36-4 |
| Molecular Weight (g/mol) | 194.19 |
| MDL Number | MFCD01047363 |
| SMILES | CC(=O)NC1=CC=CC(=C1C)[N+]([O-])=O |
| IUPAC Name | N-(2-methyl-3-nitrophenyl)acetamide |
| InChI Key | NMYFXIITWKKOKY-UHFFFAOYSA-N |
| Molecular Formula | C9H10N2O3 |
2-Hydroxybenzoic Acid 99.5+%, TCI America™
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CAS: 69-72-7 Molecular Formula: C7H6O3 Molecular Weight (g/mol): 138.12 MDL Number: MFCD00002439 InChI Key: YGSDEFSMJLZEOE-UHFFFAOYSA-N Synonym: salicylic acid,o-hydroxybenzoic acid,2-carboxyphenol,o-carboxyphenol,rutranex,salonil,retarder w,keralyt,duoplant,freezone PubChem CID: 338 ChEBI: CHEBI:16914 IUPAC Name: 2-hydroxybenzoic acid SMILES: OC(=O)C1=CC=CC=C1O
| PubChem CID | 338 |
|---|---|
| CAS | 69-72-7 |
| Molecular Weight (g/mol) | 138.12 |
| ChEBI | CHEBI:16914 |
| MDL Number | MFCD00002439 |
| SMILES | OC(=O)C1=CC=CC=C1O |
| Synonym | salicylic acid,o-hydroxybenzoic acid,2-carboxyphenol,o-carboxyphenol,rutranex,salonil,retarder w,keralyt,duoplant,freezone |
| IUPAC Name | 2-hydroxybenzoic acid |
| InChI Key | YGSDEFSMJLZEOE-UHFFFAOYSA-N |
| Molecular Formula | C7H6O3 |
2-Fluoro-5-nitrobenzaldehyde 98.0+%, TCI America™
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CAS: 27996-87-8 Molecular Formula: C7H4FNO3 Molecular Weight (g/mol): 169.111 MDL Number: MFCD00042298 InChI Key: VVXFDFQEIRGULC-UHFFFAOYSA-N Synonym: fluoro nitrobenzaldehyde,5-nitro-2-fluorobenzaldehyde,4-fluoro-3-formylnitrobenzene,2-fluoro-5-nitro-benzaldehyde,benzaldehyde, 2-fluoro-5-nitro,pubchem1459,acmc-209h0h,akos bb460,asischem d51510,2-fluoro-5 nitrobenzaldehyde PubChem CID: 2734770 IUPAC Name: 2-fluoro-5-nitrobenzaldehyde SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C=O)F
| PubChem CID | 2734770 |
|---|---|
| CAS | 27996-87-8 |
| Molecular Weight (g/mol) | 169.111 |
| MDL Number | MFCD00042298 |
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])C=O)F |
| Synonym | fluoro nitrobenzaldehyde,5-nitro-2-fluorobenzaldehyde,4-fluoro-3-formylnitrobenzene,2-fluoro-5-nitro-benzaldehyde,benzaldehyde, 2-fluoro-5-nitro,pubchem1459,acmc-209h0h,akos bb460,asischem d51510,2-fluoro-5 nitrobenzaldehyde |
| IUPAC Name | 2-fluoro-5-nitrobenzaldehyde |
| InChI Key | VVXFDFQEIRGULC-UHFFFAOYSA-N |
| Molecular Formula | C7H4FNO3 |
4-tert-Octylresorcinol 99.0+%, TCI America™
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CAS: 28122-52-3 Molecular Formula: C14H22O2 Molecular Weight (g/mol): 222.33 MDL Number: MFCD00045770 InChI Key: YQOJNENEFSZINP-UHFFFAOYSA-N Synonym: 4-tert-octylresorcinol,4-1,1,3,3-tetramethylbutyl benzene-1,3-diol,p-tert-octylresorcinol,4-2,4,4-trimethylpentan-2-yl benzene-1,3-diol,4-t-octyl resorcinol,acmc-209h0z,4-1,1,3,3-tetramethylbutyl resorcinol,1,3-benzenediol,4-1,1,3,3-tetramethylbutyl,4-1,1,3,3-tetramethylbutyl-1,3-benzenediol,1,3-benzenediol, 4-1,1,3,3-tetramethylbutyl PubChem CID: 220749 IUPAC Name: 4-(2,4,4-trimethylpentan-2-yl)benzene-1,3-diol SMILES: CC(C)(C)CC(C)(C)C1=CC=C(O)C=C1O
| PubChem CID | 220749 |
|---|---|
| CAS | 28122-52-3 |
| Molecular Weight (g/mol) | 222.33 |
| MDL Number | MFCD00045770 |
| SMILES | CC(C)(C)CC(C)(C)C1=CC=C(O)C=C1O |
| Synonym | 4-tert-octylresorcinol,4-1,1,3,3-tetramethylbutyl benzene-1,3-diol,p-tert-octylresorcinol,4-2,4,4-trimethylpentan-2-yl benzene-1,3-diol,4-t-octyl resorcinol,acmc-209h0z,4-1,1,3,3-tetramethylbutyl resorcinol,1,3-benzenediol,4-1,1,3,3-tetramethylbutyl,4-1,1,3,3-tetramethylbutyl-1,3-benzenediol,1,3-benzenediol, 4-1,1,3,3-tetramethylbutyl |
| IUPAC Name | 4-(2,4,4-trimethylpentan-2-yl)benzene-1,3-diol |
| InChI Key | YQOJNENEFSZINP-UHFFFAOYSA-N |
| Molecular Formula | C14H22O2 |
4-Chlorobenzaldehyde 97.0+%, TCI America™
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CAS: 104-88-1 Molecular Formula: C7H5ClO Molecular Weight (g/mol): 140.566 MDL Number: MFCD00003379 InChI Key: AVPYQKSLYISFPO-UHFFFAOYSA-N Synonym: p-chlorobenzaldehyde,benzaldehyde, 4-chloro,benzaldehyde, p-chloro,p-chlorobenzenecarboxaldehyde,4-chloro-benzaldehyde,4-chlorobenzenaldehyde,4-chloro benzaldehyde,ccris 857,para-chlorobenzaldehyde,unii-e67727up9z PubChem CID: 7726 ChEBI: CHEBI:28105 IUPAC Name: 4-chlorobenzaldehyde SMILES: C1=CC(=CC=C1C=O)Cl
| PubChem CID | 7726 |
|---|---|
| CAS | 104-88-1 |
| Molecular Weight (g/mol) | 140.566 |
| ChEBI | CHEBI:28105 |
| MDL Number | MFCD00003379 |
| SMILES | C1=CC(=CC=C1C=O)Cl |
| Synonym | p-chlorobenzaldehyde,benzaldehyde, 4-chloro,benzaldehyde, p-chloro,p-chlorobenzenecarboxaldehyde,4-chloro-benzaldehyde,4-chlorobenzenaldehyde,4-chloro benzaldehyde,ccris 857,para-chlorobenzaldehyde,unii-e67727up9z |
| IUPAC Name | 4-chlorobenzaldehyde |
| InChI Key | AVPYQKSLYISFPO-UHFFFAOYSA-N |
| Molecular Formula | C7H5ClO |
2,6-Dibromo-p-cresol 98.0+%, TCI America™
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CAS: 2432-14-6 Molecular Formula: C7H6Br2O Molecular Weight (g/mol): 265.932 MDL Number: MFCD00002154 InChI Key: FIGPGTJKHFAYRK-UHFFFAOYSA-N Synonym: 2,6-dibromo-p-cresol,dibromocresol,p-cresol, 2,6-dibromo,3,5-dibromo-4-hydroxytoluene,phenol, 2,6-dibromo-4-methyl,2,6-dibromo-4-methyl-phenol,attercop-chm at113597,dibromopcresol,p-cresol,6-dibromo,2,6-dibromo-p-creso PubChem CID: 17078 IUPAC Name: 2,6-dibromo-4-methylphenol SMILES: CC1=CC(=C(C(=C1)Br)O)Br
| PubChem CID | 17078 |
|---|---|
| CAS | 2432-14-6 |
| Molecular Weight (g/mol) | 265.932 |
| MDL Number | MFCD00002154 |
| SMILES | CC1=CC(=C(C(=C1)Br)O)Br |
| Synonym | 2,6-dibromo-p-cresol,dibromocresol,p-cresol, 2,6-dibromo,3,5-dibromo-4-hydroxytoluene,phenol, 2,6-dibromo-4-methyl,2,6-dibromo-4-methyl-phenol,attercop-chm at113597,dibromopcresol,p-cresol,6-dibromo,2,6-dibromo-p-creso |
| IUPAC Name | 2,6-dibromo-4-methylphenol |
| InChI Key | FIGPGTJKHFAYRK-UHFFFAOYSA-N |
| Molecular Formula | C7H6Br2O |
2,4'-Dihydroxydiphenyl Sulfone 98.0+%, TCI America™
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CAS: 5397-34-2 Molecular Formula: C12H10O4S Molecular Weight (g/mol): 250.27 MDL Number: MFCD01631305 InChI Key: LROZSPADHSXFJA-UHFFFAOYSA-N PubChem CID: 79381 IUPAC Name: 4-(2-hydroxybenzenesulfonyl)phenol SMILES: OC1=CC=C(C=C1)S(=O)(=O)C1=CC=CC=C1O
| PubChem CID | 79381 |
|---|---|
| CAS | 5397-34-2 |
| Molecular Weight (g/mol) | 250.27 |
| MDL Number | MFCD01631305 |
| SMILES | OC1=CC=C(C=C1)S(=O)(=O)C1=CC=CC=C1O |
| IUPAC Name | 4-(2-hydroxybenzenesulfonyl)phenol |
| InChI Key | LROZSPADHSXFJA-UHFFFAOYSA-N |
| Molecular Formula | C12H10O4S |
2,6-Dibromoanthracene 98.0+%, TCI America™
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CAS: 186517-01-1 Molecular Formula: C14H8Br2 Molecular Weight (g/mol): 336.026 InChI Key: BPRGLVVFWRNXEP-UHFFFAOYSA-N PubChem CID: 22058906 IUPAC Name: 2,6-dibromoanthracene SMILES: C1=CC(=CC2=CC3=C(C=C21)C=C(C=C3)Br)Br
| PubChem CID | 22058906 |
|---|---|
| CAS | 186517-01-1 |
| Molecular Weight (g/mol) | 336.026 |
| SMILES | C1=CC(=CC2=CC3=C(C=C21)C=C(C=C3)Br)Br |
| IUPAC Name | 2,6-dibromoanthracene |
| InChI Key | BPRGLVVFWRNXEP-UHFFFAOYSA-N |
| Molecular Formula | C14H8Br2 |
4-Amino-3-methoxybenzoic Acid 98.0+%, TCI America™
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CAS: 2486-69-3 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.164 MDL Number: MFCD00016539 InChI Key: JNFGLYJROFAOQP-UHFFFAOYSA-N Synonym: 4-amino-3-methoxy-benzoic acid,3-methoxy-4-aminobenzoic acid,4-amino-m-anisic acid,benzoic acid, 4-amino-3-methoxy,o-anisidine-4-carboxylic acid,4-amino-3-methoxy benzoic acid,timtec-bb sbb008622,4-amino-3-methoxybenzoic,4-amino-3-methoxybenzoic acid,4-amino-3-methoxybenzoicacid PubChem CID: 288057 IUPAC Name: 4-amino-3-methoxybenzoic acid SMILES: COC1=C(C=CC(=C1)C(=O)O)N
| PubChem CID | 288057 |
|---|---|
| CAS | 2486-69-3 |
| Molecular Weight (g/mol) | 167.164 |
| MDL Number | MFCD00016539 |
| SMILES | COC1=C(C=CC(=C1)C(=O)O)N |
| Synonym | 4-amino-3-methoxy-benzoic acid,3-methoxy-4-aminobenzoic acid,4-amino-m-anisic acid,benzoic acid, 4-amino-3-methoxy,o-anisidine-4-carboxylic acid,4-amino-3-methoxy benzoic acid,timtec-bb sbb008622,4-amino-3-methoxybenzoic,4-amino-3-methoxybenzoic acid,4-amino-3-methoxybenzoicacid |
| IUPAC Name | 4-amino-3-methoxybenzoic acid |
| InChI Key | JNFGLYJROFAOQP-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO3 |
Methyl 4-Chlorobenzoate 98.0+%, TCI America™
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CAS: 1126-46-1 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.59 MDL Number: MFCD00000621 InChI Key: LXNFVVDCCWUUKC-UHFFFAOYSA-N Synonym: methyl p-chlorobenzoate,4-chlorobenzoic acid methyl ester,benzoic acid, 4-chloro-, methyl ester,unii-m0u80j80va,benzoic acid, p-chloro-, methyl ester,methyl-p-chlorobenzoate,p-chlorobenzoic acid methyl ester,methyl-4-chlorobenzoate,4-chloro-benzoic acid methyl ester,decitabine related compound d PubChem CID: 14307 IUPAC Name: methyl 4-chlorobenzoate SMILES: COC(=O)C1=CC=C(Cl)C=C1
| PubChem CID | 14307 |
|---|---|
| CAS | 1126-46-1 |
| Molecular Weight (g/mol) | 170.59 |
| MDL Number | MFCD00000621 |
| SMILES | COC(=O)C1=CC=C(Cl)C=C1 |
| Synonym | methyl p-chlorobenzoate,4-chlorobenzoic acid methyl ester,benzoic acid, 4-chloro-, methyl ester,unii-m0u80j80va,benzoic acid, p-chloro-, methyl ester,methyl-p-chlorobenzoate,p-chlorobenzoic acid methyl ester,methyl-4-chlorobenzoate,4-chloro-benzoic acid methyl ester,decitabine related compound d |
| IUPAC Name | methyl 4-chlorobenzoate |
| InChI Key | LXNFVVDCCWUUKC-UHFFFAOYSA-N |
| Molecular Formula | C8H7ClO2 |
Methyl 3-Amino-4-methoxybenzoate 98.0+%, TCI America™
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CAS: 24812-90-6 Molecular Formula: C9H11NO3 Molecular Weight (g/mol): 181.191 InChI Key: QVDWKLDUBSJEOG-UHFFFAOYSA-N Synonym: 3-amino-4-methoxybenzoic acid methyl ester,3-amino-4-methoxy-benzoic acid methyl ester,methyl-3-amino-4-methoxybenzoate,3-amino-p-anisic acid methyl ester,methyl-4-methoxy-3-aminobenzoate,benzoic acid, 3-amino-4-methoxy-, methyl ester,pubchem2033,3-amino-4-methoxy-benzoicacidmethylester,acmc-209get,m-aminoanissauremethylester PubChem CID: 2734814 IUPAC Name: methyl 3-amino-4-methoxybenzoate SMILES: COC1=C(C=C(C=C1)C(=O)OC)N
| PubChem CID | 2734814 |
|---|---|
| CAS | 24812-90-6 |
| Molecular Weight (g/mol) | 181.191 |
| SMILES | COC1=C(C=C(C=C1)C(=O)OC)N |
| Synonym | 3-amino-4-methoxybenzoic acid methyl ester,3-amino-4-methoxy-benzoic acid methyl ester,methyl-3-amino-4-methoxybenzoate,3-amino-p-anisic acid methyl ester,methyl-4-methoxy-3-aminobenzoate,benzoic acid, 3-amino-4-methoxy-, methyl ester,pubchem2033,3-amino-4-methoxy-benzoicacidmethylester,acmc-209get,m-aminoanissauremethylester |
| IUPAC Name | methyl 3-amino-4-methoxybenzoate |
| InChI Key | QVDWKLDUBSJEOG-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO3 |
2-Amino-5-chloro-2'-fluorobenzophenone 98.0+%, TCI America™
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CAS: 784-38-3 Molecular Formula: C13H9ClFNO Molecular Weight (g/mol): 249.669 MDL Number: MFCD00038381 InChI Key: GTGMXPIQRQSORU-UHFFFAOYSA-N Synonym: 2-amino-5-chloro-2'-fluorobenzophenone,2-amino-5-chlorophenyl 2-fluorophenyl methanone,2-amino-2'-fluoro-5-chlorobenzophenone,methanone, 2-amino-5-chlorophenyl 2-fluorophenyl,4-chloro-2-2-fluorobenzoyl aniline,2-amino-5-chloro-phenyl-2-fluorophenyl methanone,2-amino-5-chlorophenyl 2-fluorophenyl ketone,2-amino-5-chlorophenyl-2-fluorophenyl methanone,pubchem3252,acmc-1bd5r PubChem CID: 69912 IUPAC Name: (2-amino-5-chlorophenyl)-(2-fluorophenyl)methanone SMILES: C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Cl)N)F
| PubChem CID | 69912 |
|---|---|
| CAS | 784-38-3 |
| Molecular Weight (g/mol) | 249.669 |
| MDL Number | MFCD00038381 |
| SMILES | C1=CC=C(C(=C1)C(=O)C2=C(C=CC(=C2)Cl)N)F |
| Synonym | 2-amino-5-chloro-2'-fluorobenzophenone,2-amino-5-chlorophenyl 2-fluorophenyl methanone,2-amino-2'-fluoro-5-chlorobenzophenone,methanone, 2-amino-5-chlorophenyl 2-fluorophenyl,4-chloro-2-2-fluorobenzoyl aniline,2-amino-5-chloro-phenyl-2-fluorophenyl methanone,2-amino-5-chlorophenyl 2-fluorophenyl ketone,2-amino-5-chlorophenyl-2-fluorophenyl methanone,pubchem3252,acmc-1bd5r |
| IUPAC Name | (2-amino-5-chlorophenyl)-(2-fluorophenyl)methanone |
| InChI Key | GTGMXPIQRQSORU-UHFFFAOYSA-N |
| Molecular Formula | C13H9ClFNO |