Thiocyanic acid, chloromethyl ester


Chemical Name: Thiocyanic acid, chloromethyl ester
CAS Number: 3268-79-9
Product Number: AG003OU9(AGN-PC-0JLQ8T)
Synonyms:
MDL No:
Molecular Formula: C2H2ClNS
Molecular Weight: 107.56198

Identification/Properties


Properties
BP:
185.0°C
Computed Properties
Molecular Weight:
107.555g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
106.96g/mol
Monoisotopic Mass:
106.96g/mol
Topological Polar Surface Area:
49.1A^2
Heavy Atom Count:
5
Formal Charge:
0
Complexity:
53.9
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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