Chem
J-GLOBAL ID：200907090872550193
Nikkaji number：J2.503.596H
2-Methyl-2-isothiocyanatooctane
2-イソチオシアナト-2-メチルオクタン
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： C10H19NS
Molecular formula furigana： C10-H19-N-S
Molecular weight： 185.330
InChI：
InChI=1S/C10H19NS/c1-4-5-6-7-8-10(2,3)11-9-12/h4-8H2,1-3H3
InChI key：
ANCOMYPIFQEZCU-UHFFFAOYSA-N
SMILES：
CCCCCCC(C)(C)N=C=S
Systematic name (3)：
- 2-メチル-2-イソチオシアナトオクタン
- 2-イソチオシアナト-2-メチルオクタン
- 2-isothiocyanato-2-methyloctane
- 2-Methyl-2-isothiocyanatooctane
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