Structure

Propane,1-chloro-3-isothiocyanato-

CAS
2799-72-6
Catalog Number
ACM2799726
Category
Other Products
Molecular Weight
135.6151
Molecular Formula
C4H6ClNS

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Specification

Synonyms
3-Chloropropyl isothiocyanate, 1-Chloro-3-isothiocyanatopropane, MolPort-000-153-533, ZINC02390117, CID137713, 2799-72-6
IUPAC Name
1-chloro-3-isothiocyanatopropane
SMILES
C(CN=C=S)CCl
InChI Key
ZGFOBQSQLJDLKV-UHFFFAOYSA-N
Boiling Point
213.9ºC at 760 mmHg
Flash Point
83.2ºC
Density
1.13 g/cm³
Appearance
clear yellow liquid
Exact Mass
134.99100
Hazard Statements
Xi,C
H-Bond Acceptor
1
H-Bond Donor
0
Safety Description
S26

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