Chem
J-GLOBAL ID：201007043948845425   Nikkaji number：J2.887.641F

3-[(1S,2R,3S)-1,3-Dimethyl-2-hydroxypentyl]pyrocatechol

3-[(1S,2R,3S)-1,3-ジメチル-2-ヒドロキシペンチル]ピロカテコール
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： C13H20O3
Molecular formula furigana： C13-H20-O3
Molecular weight： 224.300
InChI： InChI=1S/C13H20O3/c1-4-8(2)12(15)9(3)10-6-5-7-11(14)13(10)16/h5-9,12,14-16H,4H2,1-3H3/t8-,9-,12+/m0/s1
InChI key： GRSWMUMWMWABRL-HOTUBEGUSA-N
SMILES： CC[C@H](C)[C@@H](O)[C@@H](C)c1cccc(O)c1O
Systematic name  (3)：
  • 3-[(1S,2R,3S)-1,3-ジメチル-2-ヒドロキシペンチル]ピロカテコール
  • 3-[(2S,3R,4S)-3-ヒドロキシ-4-メチルヘキサン-2-イル]ベンゼン-1,2-ジオール
  • 3-[(2S,3R,4S)-3-hydroxy-4-methylhexan-2-yl]benzene-1,2-diol
Other name (1)：
  • 3-[(1S,2R,3S)-1,3-Dimethyl-2-hydroxypentyl]pyrocatechol
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