Chem
J-GLOBAL ID：200907094393550419
Nikkaji number：J1.198.019H
(2R,4R)-3,3-Dimethyl-2,4-pentanediol
(2R,4R)-3,3-ジメチル-2,4-ペンタンジオール
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： C7H16O2
Molecular formula furigana： C7-H16-O2
Molecular weight： 132.203
InChI：
InChI=1S/C7H16O2/c1-5(8)7(3,4)6(2)9/h5-6,8-9H,1-4H3/t5-,6-/m1/s1
InChI key：
FVSGQDYLPCUSNF-PHDIDXHHSA-N
SMILES：
C[C@@H](O)C(C)(C)[C@@H](C)O
Systematic name (3)：
- (2R,4R)-3,3-ジメチル-2,4-ペンタンジオール
- (2R,4R)-3,3-ジメチルペンタン-2,4-ジオール
- (2R,4R)-3,3-dimethylpentane-2,4-diol
- (2R,4R)-3,3-Dimethyl-2,4-pentanediol
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