Chem
J-GLOBAL ID:200907050652120269   Nikkaji number:J1.594.183I

(3S,4R,5S)-3-Ethyl-2,4-dimethyl-3,5-heptanediol

(3S,4R,5S)-3-エチル-2,4-ジメチル-3,5-ヘプタンジオール
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: C11H24O2
Molecular formula furigana: C11-H24-O2
Molecular weight: 188.311
InChI: InChI=1S/C11H24O2/c1-6-10(12)9(5)11(13,7-2)8(3)4/h8-10,12-13H,6-7H2,1-5H3/t9-,10+,11+/m1/s1
InChI key: TYUSWZYTLVTZSL-VWYCJHECSA-N
SMILES: CC[C@H](O)[C@@H](C)[C@](O)(CC)C(C)C
Systematic name  (3):
  • (3S,4R,5S)-3-エチル-2,4-ジメチル-3,5-ヘプタンジオール
  • (3S,4R,5S)-3-エチル-2,4-ジメチルヘプタン-3,5-ジオール
  • (3S,4R,5S)-3-ethyl-2,4-dimethylheptane-3,5-diol
Other name (1):
  • (3S,4R,5S)-3-Ethyl-2,4-dimethyl-3,5-heptanediol
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