Chem
J-GLOBAL ID：200907060322249309   Nikkaji number：J4.978F

4-Nitrobenzyl chloride

4-ニトロベンジルクロリド
Substance type：
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
Molecular formula： C7H6Cl[N+]O[O-]
Molecular formula furigana： C7-H6-CL-N-O2
Molecular weight： 171.580
InChI： InChI=1S/C7H6ClNO2/c8-5-6-1-3-7(4-2-6)9(10)11/h1-4H,5H2
InChI key： KGCNHWXDPDPSBV-UHFFFAOYSA-N
SMILES： [O-][N+](=O)c1ccc(CCl)cc1
Systematic name  (10)：
  • 4-(クロロメチル)-1-ニトロベンゼン
  • 4-ニトロベンジルクロリド
  • α-クロロ-4-ニトロトルエン
  • 1-(クロロメチル)-4-ニトロベンゼン
  • 1-クロロメチル-4-ニトロベンゼン
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Other name (10)：
  • p-ニトロベンジルクロリド
  • p-Nitrobenzyl chloride
  • α-Chloro-p-nitrotoluene
  • 1-(Chloromethyl)-4-nitrobenzene
  • 1-Chloromethyl-4-nitrobenzene
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CAS registry number： 100-14-1
Regulation number (6)：
  • 4-(12)-141
  • 4-(12)-314
  • XS9093000
  • (3)-449
  • EINECS2028227
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