Benzene and substituted derivatives
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N-(2,4-Dinitrophenyl)-6-aminohexanoic Acid 95.0+%, TCI America™
CAS: 10466-72-5 Molecular Formula: C12H15N3O6 Molecular Weight (g/mol): 297.27 MDL Number: MFCD00038470 InChI Key: ZYUWUKIAUDIXCQ-UHFFFAOYSA-N Synonym: N-Dnp-6-aminohexanoic Acid PubChem CID: 96812 ChEBI: CHEBI:53698 IUPAC Name: 6-[(2,4-dinitrophenyl)amino]hexanoic acid SMILES: OC(=O)CCCCCNC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O
| PubChem CID | 96812 |
|---|---|
| CAS | 10466-72-5 |
| Molecular Weight (g/mol) | 297.27 |
| ChEBI | CHEBI:53698 |
| MDL Number | MFCD00038470 |
| SMILES | OC(=O)CCCCCNC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O |
| Synonym | N-Dnp-6-aminohexanoic Acid |
| IUPAC Name | 6-[(2,4-dinitrophenyl)amino]hexanoic acid |
| InChI Key | ZYUWUKIAUDIXCQ-UHFFFAOYSA-N |
| Molecular Formula | C12H15N3O6 |
2-Bromo-4,6-dichloroaniline 97.0+%, TCI America™
CAS: 697-86-9 Molecular Formula: C6H4BrCl2N Molecular Weight (g/mol): 240.909 MDL Number: MFCD00040936 InChI Key: DTPADCOGQUOGHT-UHFFFAOYSA-N Synonym: pubchem3605,acmc-209ob3,6-bromo-2,4-dichloroaniline,2,4-dichloro-6-bromoaniline,2-bromo-4,6-dichloro-aniline,6-bromo-2,4-dichlorophenylamine,benzenamine,2-bromo-4,6-dichloro,2-bromo-4,6-dichloroaniline,2-bromanyl-4,6-bis chloranyl aniline PubChem CID: 2756901 IUPAC Name: 2-bromo-4,6-dichloroaniline SMILES: C1=C(C=C(C(=C1Cl)N)Br)Cl
| PubChem CID | 2756901 |
|---|---|
| CAS | 697-86-9 |
| Molecular Weight (g/mol) | 240.909 |
| MDL Number | MFCD00040936 |
| SMILES | C1=C(C=C(C(=C1Cl)N)Br)Cl |
| Synonym | pubchem3605,acmc-209ob3,6-bromo-2,4-dichloroaniline,2,4-dichloro-6-bromoaniline,2-bromo-4,6-dichloro-aniline,6-bromo-2,4-dichlorophenylamine,benzenamine,2-bromo-4,6-dichloro,2-bromo-4,6-dichloroaniline,2-bromanyl-4,6-bis chloranyl aniline |
| IUPAC Name | 2-bromo-4,6-dichloroaniline |
| InChI Key | DTPADCOGQUOGHT-UHFFFAOYSA-N |
| Molecular Formula | C6H4BrCl2N |
2,4-Dinitro-5-fluoroaniline 98.0+%, TCI America™
CAS: 367-81-7 Molecular Formula: C6H4FN3O4 Molecular Weight (g/mol): 201.113 MDL Number: MFCD00007150 InChI Key: RAGRTYREMCPEIV-UHFFFAOYSA-N Synonym: 5-Fluoro-2,4-dinitroaniline PubChem CID: 73944 IUPAC Name: 5-fluoro-2,4-dinitroaniline SMILES: C1=C(C(=CC(=C1F)[N+](=O)[O-])[N+](=O)[O-])N
| PubChem CID | 73944 |
|---|---|
| CAS | 367-81-7 |
| Molecular Weight (g/mol) | 201.113 |
| MDL Number | MFCD00007150 |
| SMILES | C1=C(C(=CC(=C1F)[N+](=O)[O-])[N+](=O)[O-])N |
| Synonym | 5-Fluoro-2,4-dinitroaniline |
| IUPAC Name | 5-fluoro-2,4-dinitroaniline |
| InChI Key | RAGRTYREMCPEIV-UHFFFAOYSA-N |
| Molecular Formula | C6H4FN3O4 |
Methyl 4-Amino-2-methoxybenzoate 98.0+%, TCI America™
CAS: 27492-84-8 Molecular Formula: C9H11NO3 Molecular Weight (g/mol): 181.19 MDL Number: MFCD00017202 InChI Key: YUPQMVSYNJQULF-UHFFFAOYSA-N Synonym: methyl 4-amino-o-anisate,4-amino-2-methoxybenzoic acid methyl ester,benzoic acid, 4-amino-2-methoxy-, methyl ester,methyl 2-methoxy-4-aminobenzoate,methyl 4-amino-2-methoxy-benzoate,4-amino-o-anisic acid methyl ester,methyl 4-amino-2-methoxybenzenecarboxylate,2-methoxy-4-aminobenzoic acid methyl ester,ethylbenzyl dimethyltetradecylammonium chloride,pubchem4712 PubChem CID: 168705 IUPAC Name: methyl 4-amino-2-methoxybenzoate SMILES: COC(=O)C1=CC=C(N)C=C1OC
| PubChem CID | 168705 |
|---|---|
| CAS | 27492-84-8 |
| Molecular Weight (g/mol) | 181.19 |
| MDL Number | MFCD00017202 |
| SMILES | COC(=O)C1=CC=C(N)C=C1OC |
| Synonym | methyl 4-amino-o-anisate,4-amino-2-methoxybenzoic acid methyl ester,benzoic acid, 4-amino-2-methoxy-, methyl ester,methyl 2-methoxy-4-aminobenzoate,methyl 4-amino-2-methoxy-benzoate,4-amino-o-anisic acid methyl ester,methyl 4-amino-2-methoxybenzenecarboxylate,2-methoxy-4-aminobenzoic acid methyl ester,ethylbenzyl dimethyltetradecylammonium chloride,pubchem4712 |
| IUPAC Name | methyl 4-amino-2-methoxybenzoate |
| InChI Key | YUPQMVSYNJQULF-UHFFFAOYSA-N |
| Molecular Formula | C9H11NO3 |
3-Methoxyphenyl Isocyanate 97.0+%, TCI America™
CAS: 18908-07-1 Molecular Formula: C8H7NO2 Molecular Weight (g/mol): 149.149 MDL Number: MFCD00002019 InChI Key: NPOVTGVGOBJZPY-UHFFFAOYSA-N Synonym: 3-methoxyphenyl isocyanate,benzene, 1-isocyanato-3-methoxy,isocyanic acid 3-methoxyphenyl ester,3-isocyanatoanisole,3-methoxyphenylisocyanate,m-methoxyphenyl isocyanate,1-isocyanato-3-methoxy-benzene,3-methoxybenzenisocyanate,m-anisyl isocyanate,m-methoxyphenylisocyanate PubChem CID: 87843 IUPAC Name: 1-isocyanato-3-methoxybenzene SMILES: COC1=CC=CC(=C1)N=C=O
| PubChem CID | 87843 |
|---|---|
| CAS | 18908-07-1 |
| Molecular Weight (g/mol) | 149.149 |
| MDL Number | MFCD00002019 |
| SMILES | COC1=CC=CC(=C1)N=C=O |
| Synonym | 3-methoxyphenyl isocyanate,benzene, 1-isocyanato-3-methoxy,isocyanic acid 3-methoxyphenyl ester,3-isocyanatoanisole,3-methoxyphenylisocyanate,m-methoxyphenyl isocyanate,1-isocyanato-3-methoxy-benzene,3-methoxybenzenisocyanate,m-anisyl isocyanate,m-methoxyphenylisocyanate |
| IUPAC Name | 1-isocyanato-3-methoxybenzene |
| InChI Key | NPOVTGVGOBJZPY-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO2 |
2,6-Dibromo-4-(trifluoromethoxy)aniline 98.0+%, TCI America™
CAS: 88149-49-9 Molecular Formula: C7H4Br2F3NO Molecular Weight (g/mol): 334.92 MDL Number: MFCD00153113 InChI Key: JBSWOEGXMADXOU-UHFFFAOYSA-N Synonym: 2,6-dibromo-4-trifluoromethoxy aniline,bromo riluzole impurity,3,5-dibromo-4-aminotrifluoromethoxybenzene,2,6-dibromo-4-trifluoromethoxy benzenamine,2-amino-1,3-dibromo-5-trifluoromethoxy benzene,2,6dibromo-4-trifluoromethoxy aniline,2,6-dibromo-4-trifluoro-methoxy aniline,benzenamine, 2,6-dibromo-4-trifluoromethoxy,pubchem10031 PubChem CID: 2736797 IUPAC Name: 2,6-dibromo-4-(trifluoromethoxy)aniline SMILES: NC1=C(Br)C=C(OC(F)(F)F)C=C1Br
| PubChem CID | 2736797 |
|---|---|
| CAS | 88149-49-9 |
| Molecular Weight (g/mol) | 334.92 |
| MDL Number | MFCD00153113 |
| SMILES | NC1=C(Br)C=C(OC(F)(F)F)C=C1Br |
| Synonym | 2,6-dibromo-4-trifluoromethoxy aniline,bromo riluzole impurity,3,5-dibromo-4-aminotrifluoromethoxybenzene,2,6-dibromo-4-trifluoromethoxy benzenamine,2-amino-1,3-dibromo-5-trifluoromethoxy benzene,2,6dibromo-4-trifluoromethoxy aniline,2,6-dibromo-4-trifluoro-methoxy aniline,benzenamine, 2,6-dibromo-4-trifluoromethoxy,pubchem10031 |
| IUPAC Name | 2,6-dibromo-4-(trifluoromethoxy)aniline |
| InChI Key | JBSWOEGXMADXOU-UHFFFAOYSA-N |
| Molecular Formula | C7H4Br2F3NO |
N-Succinimidyl 4-Benzoylbenzoate 98.0+%, TCI America™
CAS: 91990-88-4 Molecular Formula: C18H13NO5 Molecular Weight (g/mol): 323.30 MDL Number: MFCD00058572 InChI Key: MVQNJLJLEGZFGP-UHFFFAOYSA-N Synonym: 4-Benzoylbenzoic Acid N-Succinimidyl Ester PubChem CID: 2762595 IUPAC Name: 2,5-dioxopyrrolidin-1-yl 4-benzoylbenzoate SMILES: O=C(ON1C(=O)CCC1=O)C1=CC=C(C=C1)C(=O)C1=CC=CC=C1
| PubChem CID | 2762595 |
|---|---|
| CAS | 91990-88-4 |
| Molecular Weight (g/mol) | 323.30 |
| MDL Number | MFCD00058572 |
| SMILES | O=C(ON1C(=O)CCC1=O)C1=CC=C(C=C1)C(=O)C1=CC=CC=C1 |
| Synonym | 4-Benzoylbenzoic Acid N-Succinimidyl Ester |
| IUPAC Name | 2,5-dioxopyrrolidin-1-yl 4-benzoylbenzoate |
| InChI Key | MVQNJLJLEGZFGP-UHFFFAOYSA-N |
| Molecular Formula | C18H13NO5 |
4-Methoxybenzophenone 98.0+%, TCI America™
CAS: 611-94-9 Molecular Formula: C14H12O2 Molecular Weight (g/mol): 212.248 MDL Number: MFCD00008403 InChI Key: SWFHGTMLYIBPPA-UHFFFAOYSA-N Synonym: 4-methoxybenzophenone,4-methoxyphenyl phenyl methanone,p-methoxybenzophenone,benzophenone, 4-methoxy,methanone, 4-methoxyphenyl phenyl,phenyl p-anisyl ketone,4-benzoylanisole,4-methoxyphenyl phenylmethanone,unii-i4xj07373m,4-methoxyphenyl-phenylmethanone PubChem CID: 69146 IUPAC Name: (4-methoxyphenyl)-phenylmethanone SMILES: COC1=CC=C(C=C1)C(=O)C2=CC=CC=C2
| PubChem CID | 69146 |
|---|---|
| CAS | 611-94-9 |
| Molecular Weight (g/mol) | 212.248 |
| MDL Number | MFCD00008403 |
| SMILES | COC1=CC=C(C=C1)C(=O)C2=CC=CC=C2 |
| Synonym | 4-methoxybenzophenone,4-methoxyphenyl phenyl methanone,p-methoxybenzophenone,benzophenone, 4-methoxy,methanone, 4-methoxyphenyl phenyl,phenyl p-anisyl ketone,4-benzoylanisole,4-methoxyphenyl phenylmethanone,unii-i4xj07373m,4-methoxyphenyl-phenylmethanone |
| IUPAC Name | (4-methoxyphenyl)-phenylmethanone |
| InChI Key | SWFHGTMLYIBPPA-UHFFFAOYSA-N |
| Molecular Formula | C14H12O2 |
2,3,4,4'-Tetrahydroxybenzophenone 98.0+%, TCI America™
CAS: 31127-54-5 Molecular Formula: C13H10O5 Molecular Weight (g/mol): 246.218 MDL Number: MFCD00083097 InChI Key: ZRDYULMDEGRWRC-UHFFFAOYSA-N PubChem CID: 919792 IUPAC Name: (4-hydroxyphenyl)-(2,3,4-trihydroxyphenyl)methanone SMILES: C1=CC(=CC=C1C(=O)C2=C(C(=C(C=C2)O)O)O)O
| PubChem CID | 919792 |
|---|---|
| CAS | 31127-54-5 |
| Molecular Weight (g/mol) | 246.218 |
| MDL Number | MFCD00083097 |
| SMILES | C1=CC(=CC=C1C(=O)C2=C(C(=C(C=C2)O)O)O)O |
| IUPAC Name | (4-hydroxyphenyl)-(2,3,4-trihydroxyphenyl)methanone |
| InChI Key | ZRDYULMDEGRWRC-UHFFFAOYSA-N |
| Molecular Formula | C13H10O5 |
3,3'-Diaminobenzophenone 95.0+%, TCI America™
CAS: 611-79-0 Molecular Formula: C13H12N2O Molecular Weight (g/mol): 212.25 MDL Number: MFCD00014774 InChI Key: TUQQUUXMCKXGDI-UHFFFAOYSA-N Synonym: 3,3'-diaminobenzophenone,bis 3-aminophenyl methanone,methanone, bis 3-aminophenyl,di3-aminophenyl ketone,3,3'-diaminodiphenyl ketone,pubchem3381,acmc-1awhc,cbmicro_014188,3,3'-diamino benzophenone,3-3-aminobenzoyl aniline PubChem CID: 69145 IUPAC Name: 3-(3-aminobenzoyl)aniline SMILES: NC1=CC(=CC=C1)C(=O)C1=CC(N)=CC=C1
| PubChem CID | 69145 |
|---|---|
| CAS | 611-79-0 |
| Molecular Weight (g/mol) | 212.25 |
| MDL Number | MFCD00014774 |
| SMILES | NC1=CC(=CC=C1)C(=O)C1=CC(N)=CC=C1 |
| Synonym | 3,3'-diaminobenzophenone,bis 3-aminophenyl methanone,methanone, bis 3-aminophenyl,di3-aminophenyl ketone,3,3'-diaminodiphenyl ketone,pubchem3381,acmc-1awhc,cbmicro_014188,3,3'-diamino benzophenone,3-3-aminobenzoyl aniline |
| IUPAC Name | 3-(3-aminobenzoyl)aniline |
| InChI Key | TUQQUUXMCKXGDI-UHFFFAOYSA-N |
| Molecular Formula | C13H12N2O |
4-Benzyloxybenzophenone 98.0+%, TCI America™
CAS: 54589-41-2 Molecular Formula: C20H16O2 Molecular Weight (g/mol): 288.346 MDL Number: MFCD00017508 InChI Key: NMPNTBQOLRXPGK-UHFFFAOYSA-N Synonym: 4-benzyloxybenzophenone,4-benzyloxy benzophenone,4-benzyloxy phenyl phenyl methanone,phenyl-4-phenylmethoxyphenyl methanone,phenyl 4-phenylmethoxy phenyl ketone,acmc-20amoo,4-benzyl-oxybenzophenone,4-benzyloxyphenyl-phenyl-methanone PubChem CID: 458193 IUPAC Name: phenyl-(4-phenylmethoxyphenyl)methanone SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)C3=CC=CC=C3
| PubChem CID | 458193 |
|---|---|
| CAS | 54589-41-2 |
| Molecular Weight (g/mol) | 288.346 |
| MDL Number | MFCD00017508 |
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)C(=O)C3=CC=CC=C3 |
| Synonym | 4-benzyloxybenzophenone,4-benzyloxy benzophenone,4-benzyloxy phenyl phenyl methanone,phenyl-4-phenylmethoxyphenyl methanone,phenyl 4-phenylmethoxy phenyl ketone,acmc-20amoo,4-benzyl-oxybenzophenone,4-benzyloxyphenyl-phenyl-methanone |
| IUPAC Name | phenyl-(4-phenylmethoxyphenyl)methanone |
| InChI Key | NMPNTBQOLRXPGK-UHFFFAOYSA-N |
| Molecular Formula | C20H16O2 |
4-Bromo-4'-chlorobenzophenone 98.0+%, TCI America™
CAS: 27428-57-5 Molecular Formula: C13H8BrClO Molecular Weight (g/mol): 295.56 MDL Number: MFCD00045208 InChI Key: FYMCXGILCMIOKD-UHFFFAOYSA-N PubChem CID: 2756868 IUPAC Name: (4-bromophenyl)(4-chlorophenyl)methanone SMILES: ClC1=CC=C(C=C1)C(=O)C1=CC=C(Br)C=C1
| PubChem CID | 2756868 |
|---|---|
| CAS | 27428-57-5 |
| Molecular Weight (g/mol) | 295.56 |
| MDL Number | MFCD00045208 |
| SMILES | ClC1=CC=C(C=C1)C(=O)C1=CC=C(Br)C=C1 |
| IUPAC Name | (4-bromophenyl)(4-chlorophenyl)methanone |
| InChI Key | FYMCXGILCMIOKD-UHFFFAOYSA-N |
| Molecular Formula | C13H8BrClO |
4-(Bromomethyl)benzophenone 96.0+%, TCI America™
CAS: 32752-54-8 Molecular Formula: C14H11BrO Molecular Weight (g/mol): 275.145 MDL Number: MFCD00092076 InChI Key: RYULULVJWLRDQH-UHFFFAOYSA-N PubChem CID: 122951 IUPAC Name: [4-(bromomethyl)phenyl]-phenylmethanone SMILES: C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)CBr
| PubChem CID | 122951 |
|---|---|
| CAS | 32752-54-8 |
| Molecular Weight (g/mol) | 275.145 |
| MDL Number | MFCD00092076 |
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)CBr |
| IUPAC Name | [4-(bromomethyl)phenyl]-phenylmethanone |
| InChI Key | RYULULVJWLRDQH-UHFFFAOYSA-N |
| Molecular Formula | C14H11BrO |
2-Fluorobenzophenone 98.0+%, TCI America™
CAS: 342-24-5 Molecular Formula: C13H9FO Molecular Weight (g/mol): 200.212 MDL Number: MFCD00000318 InChI Key: DWFDQVMFSLLMPE-UHFFFAOYSA-N Synonym: 2-fluorobenzophenone,2-fluorophenyl phenyl methanone,o-fluorobenzophenone,fluorobenzophenone,2-fluorophenyl-phenylmethanone,2-fluoro-phenyl-phenylmethanone,2-fluorophenyl phenyl ketone,methanone, 2-fluorophenyl phenyl,pubchem4228,acmc-1ckt6 PubChem CID: 67650 IUPAC Name: (2-fluorophenyl)-phenylmethanone SMILES: C1=CC=C(C=C1)C(=O)C2=CC=CC=C2F
| PubChem CID | 67650 |
|---|---|
| CAS | 342-24-5 |
| Molecular Weight (g/mol) | 200.212 |
| MDL Number | MFCD00000318 |
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC=CC=C2F |
| Synonym | 2-fluorobenzophenone,2-fluorophenyl phenyl methanone,o-fluorobenzophenone,fluorobenzophenone,2-fluorophenyl-phenylmethanone,2-fluoro-phenyl-phenylmethanone,2-fluorophenyl phenyl ketone,methanone, 2-fluorophenyl phenyl,pubchem4228,acmc-1ckt6 |
| IUPAC Name | (2-fluorophenyl)-phenylmethanone |
| InChI Key | DWFDQVMFSLLMPE-UHFFFAOYSA-N |
| Molecular Formula | C13H9FO |