Propanoic acid,3-isothiocyanato-,ethyl ester

CAS

17126-62-4

Catalog Number

ACM17126624

Category

Other Products

Molecular Weight

159.21

Molecular Formula

C₆H₉NO₂S

MSDS COA Spec Sheet

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Specification

Synonyms

3-Isothiocyanato-propionic acid ethyl ester, CID526514, ZINC02390116, 17126-62-4

IUPAC Name

ethyl 3-isothiocyanatopropanoate

Canonical SMILES

CCOC(=O)CCN=C=S

InChI Key

UPTRONYNXNYITM-UHFFFAOYSA-N

Boiling Point

242.9ºC at 760mmHg

Flash Point

100.7ºC

Exact Mass

159.03500

H-Bond Acceptor

H-Bond Donor

Packing Group

III

Safety Description

S26-S36/37/39

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