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Structure

Propanoic acid,2-isothiocyanato-,methyl ester

CAS
21055-39-0
Catalog Number
ACM21055390
Category
Other Products
Molecular Weight
145.18
Molecular Formula
C5H7NO2S

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Specification

Synonyms
METHYL 2-ISOTHIOCYANATOPROPANOATE;METHYL 2-ISOTHIOCYANATO PROPIONATE
IUPAC Name
methyl (2R)-2-isothiocyanatopropanoate
Canonical SMILES
CC(C(=O)OC)N=C=S
InChI Key
LFRBLTIOKKCLSD-SCSAIBSYSA-N
Boiling Point
198.8ºC at 760 mmHg
Flash Point
74ºC
Density
1.13g/cm³
Exact Mass
145.02000
H-Bond Acceptor
3
H-Bond Donor
0
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