Structure

Cetyl chloride

CAS
4860-03-1
Catalog Number
ACM4860031
Category
Other Products
Molecular Weight
260.9g/mol
Molecular Formula
C16H33Cl

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Specification

Description
Liquid
IUPAC Name
1-chlorohexadecane
Canonical SMILES
CCCCCCCCCCCCCCCCCl
InChI
InChI=1S/C16H33Cl/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h2-16H2,1H3
InChI Key
CLWAXFZCVYJLLM-UHFFFAOYSA-N
Boiling Point
322.0 °C
Melting Point
17.9 °C
Complexity
123
Covalently-Bonded Unit Count
1
EC Number
225-461-7
Exact Mass
260.227079g/mol
Formal Charge
0
H-Bond Acceptor
0
H-Bond Donor
0
Heavy Atom Count
17
Monoisotopic Mass
260.227079g/mol
NSC Number
57106;43727
Rotatable Bond Count
14
UNII
WQ5ZKS3EK3
Vapor Pressure
6.20e-05 mmHg
XLogP3
9
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