Basic information
- CAS
54381-13-4- Standard SMILES
COc1ccc(Nc2ccccc2[N+](=O)[O-])cc1- InChIKey
JLIRPISIPQMEDU-UHFFFAOYSA-N- Molecular formula
- C13H12N2O3
- Average molar mass
- 244.25 g/mol
- Monoisotopic mass
- 244.08479225
Names & identifiers
- Preferred name
- N-(4-Methoxyphenyl)-2-nitroaniline
- IUPAC
- N-(4-methoxyphenyl)-2-nitroaniline
- English name
- N-(4-METHOXYPHENYL)-2-NITROBENZENAMINE
- Molecular formula
- C13H12N2O3
- Molecular weight
- 244.25
Names & synonyms
N-(4-Methoxyphenyl)-2-nitroaniline54381-13-4N-(4-Methoxyphenyl)-2-nitrobenzenamine4-Methoxy-2'-nitrodiphenylamine4-Methoxyphenyl 2-nitrophenylamine4-methoxy-N-(2-nitrophenyl)aniline2-Nitro-N-(4-methoxyphenyl)anilineN-(4-Methoxyphenyl)-2-nitrobenzylamineSCHEMBL3913669N-(2-Nitrophenyl)-p-anisidineSCHEMBL30310075DTXSID30347157
Show more names
N-(4-Methoxyphenyl)-2-nitroanilinBenzenamine, N-(4-methoxyphenyl)-2-nitro-3-ethyl-3-methyl-2-oxo-7-phenylheptanoic acid
MFCD03410307STK182607AKOS001064240HS-3411N-(4-Methoxyphenyl)-2-nitroaniline #SB808662''-NITRO-4-METHOXYDIPHENYLAMINEAC-16646
Database identifiers
- CAS
54381-13-4- PubChem CID
- 618504
- DTXSID
DTXSID30347157- Nikkaji
- J303.798C
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 67.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 272
Physicochemical properties
- Melting point
- 89 °C · 89 °C
- Boiling point
- 387.9 · 387.9±27.0 °C(Predicted)
- Density
- 1.276 · 1.276±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- pka
- -2.7 · -2.70±0.40(Predicted)
- CAS DataBase Reference
- 54381 · 54381-13-4(CAS DataBase Reference)
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers16 total
南京凯美西化工有限公司02558748998 18951874644 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
苏州市森菲达化工有限公司18796480002 18796480002 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
山东李比希生物医药科技有限公司15318973357; 15318973357 · [email protected]
陕西麟邦实业有限公司17709134430 · [email protected]
天成化工(江苏)有限公司0512-66387919 18662433356 · [email protected]
成都瑞欧克科技有限公司028-64353063 · [email protected]
安徽凯泽合联医药科技有限公司18130062233 · [email protected]
Related reactions
6 records
Compound notes
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