Chem
J-GLOBAL ID：200907007846674360   Nikkaji number：J1.403.755A

2-Amino-2-[4-(heptylthio)phenethyl]-1,3-propanediol

2-アミノ-2-[4-(ヘプチルチオ)フェネチル]-1,3-プロパンジオール
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： C18H31NO2S
Molecular formula furigana： C18-H31-N-O2-S
Molecular weight： 325.510
InChI： InChI=1S/C18H31NO2S/c1-2-3-4-5-6-13-22-17-9-7-16(8-10-17)11-12-18(19,14-20)15-21/h7-10,20-21H,2-6,11-15,19H2,1H3
InChI key： NYCNNQNGJYJNSA-UHFFFAOYSA-N
SMILES： CCCCCCCSc1ccc(CCC(N)(CO)CO)cc1
Systematic name  (3)：
  • 2-アミノ-2-[4-(ヘプチルチオ)フェネチル]-1,3-プロパンジオール
  • 2-アミノ-2-{2-[4-(ヘプチルスルファニル)フェニル]エチル}プロパン-1,3-ジオール
  • 2-amino-2-{2-[4-(heptylsulfanyl)phenyl]ethyl}propane-1,3-diol
Other name (1)：
  • 2-Amino-2-[4-(heptylthio)phenethyl]-1,3-propanediol
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