Chem
J-GLOBAL ID：200907010631225115
Nikkaji number：J2.491K
3-Nitrobenzoic acid
3-ニトロ安息香酸
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Molecular formula： C7H5[N+]O3[O-]
Molecular formula furigana： C7-H5-N-O4
Molecular weight： 167.120
InChI：
InChI=1S/C7H5NO4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H,(H,9,10)
InChI key：
AFPHTEQTJZKQAQ-UHFFFAOYSA-N
SMILES：
OC(=O)c1cccc(c1)[N+](=O)[O-]
Systematic name (3)：
- m-ニトロ安息香酸
- 3-ニトロ安息香酸
- 3-nitrobenzoic acid
- 3-Nitrobenzoic acid
- m-Nitrobenzoic acid
Regulation number (4)：
- DH5000000
- (3)-1505
- EINECS2045085
- TSCA(121-92-6)
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