Chem
J-GLOBAL ID：200907055088044982   Nikkaji number：J94.875F

3,3-Dimethyl-1-butanol

3,3-ジメチル-1-ブタノール
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： C6H14O
Molecular formula furigana： C6-H14-O
Molecular weight： 102.177
InChI： InChI=1S/C6H14O/c1-6(2,3)4-5-7/h7H,4-5H2,1-3H3
InChI key： DUXCSEISVMREAX-UHFFFAOYSA-N
SMILES： CC(C)(C)CCO
Systematic name  (4)：
  • 3,3-ジメチル-1-ブタノール
  • 3,3-ジメチルブタン-1-オール
  • 3,3-ジメチルブチルアルコール
  • 3,3-dimethylbutan-1-ol
Other name (5)：
  • ネオヘキサノール
  • Neohexanol
  • 3,3-Dimethyl-1-butanol
  • 3,3-Dimethylbutane-1-ol
  • 3,3-Dimethylbutyl alcohol
CAS registry number： 624-95-3
Regulation number (3)：
  • (2)-217
  • EINECS2108726
  • TSCA(624-95-3)
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