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Structure

Hexadecyl isothiocyanate

CAS
4426-87-3
Catalog Number
ACM4426873
Category
Other Products
Molecular Weight
283.52
Molecular Formula
C17H33NS

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Specification

Synonyms
Hexadecyl isothiocyanate, 1-Isothiocyanatohexadecane, CID138233, 4426-87-3
IUPAC Name
1-isothiocyanatohexadecane
Canonical SMILES
CCCCCCCCCCCCCCCCN=C=S
InChI Key
KLULJVSOVKADRQ-UHFFFAOYSA-N
Boiling Point
349.8ºC at 760mmHg
Flash Point
174.5ºC
Density
0.88g/cm³
Exact Mass
283.23300
H-Bond Acceptor
1
H-Bond Donor
0
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