(3S)-3-(Isocyanatomethyl)-5-methylhexanoic acid

Modify Date: 2025-08-21 23:19:08

(3S)-3-(Isocyanatomethyl)-5-methylhexanoic acid Structure
(3S)-3-(Isocyanatomethyl)-5-methylhexanoic acid structure
Common Name (3S)-3-(Isocyanatomethyl)-5-methylhexanoic acid
CAS Number 2102350-92-3 Molecular Weight 185.220
Density 1.1±0.1 g/cm3 Boiling Point 301.7±25.0 °C at 760 mmHg
Molecular Formula C9H15NO3 Melting Point N/A
MSDS N/A Flash Point 136.2±23.2 °C

 Names

Name (3S)-3-(Isocyanatomethyl)-5-methylhexanoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.1±0.1 g/cm3
Boiling Point 301.7±25.0 °C at 760 mmHg
Molecular Formula C9H15NO3
Molecular Weight 185.220
Flash Point 136.2±23.2 °C
Exact Mass 185.105194
LogP 2.61
Vapour Pressure 0.0±1.3 mmHg at 25°C
Index of Refraction 1.484
InChIKey GRZPGJWQKHHQTO-QMMMGPOBSA-N
SMILES CC(C)CC(CN=C=O)CC(=O)O

 Synonyms

Hexanoic acid, 3-(isocyanatomethyl)-5-methyl-, (3S)-
(3S)-3-(Isocyanatomethyl)-5-methylhexanoic acid
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