Chem
J-GLOBAL ID：200907015438749176
Nikkaji number：J96.173F
3-Iodobenzoic acid
3-ヨード安息香酸
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： C7H5IO2
Molecular formula furigana： C7-H5-I-O2
Molecular weight： 248.019
InChI：
InChI=1S/C7H5IO2/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,(H,9,10)
InChI key：
KVBWBCRPWVKFQT-UHFFFAOYSA-N
SMILES：
OC(=O)c1cccc(I)c1
Systematic name (4)：
- 3-ヨードベンゼンカルボン酸
- m-ヨード安息香酸
- 3-ヨード安息香酸
- 3-iodobenzoic acid
- m-Iodobenzoic acid
- 3-Iodobenzoic acid
Regulation number (3)：
- EINECS2105552
- TSCA(618-51-9)
- 4-(4)-1261
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