Thiazole, 2-chloro-4-(chloromethyl)-


Chemical Name: Thiazole, 2-chloro-4-(chloromethyl)-
CAS Number: 5198-76-5
Product Number: AG00D808(AGN-PC-0NCUOM)
Synonyms:
MDL No:
Molecular Formula: C4H3Cl2NS
Molecular Weight: 168.0443

Identification/Properties


Computed Properties
Molecular Weight:
168.035g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
166.936g/mol
Monoisotopic Mass:
166.936g/mol
Topological Polar Surface Area:
41.1A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
80.4
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


GHS Pictogram:
Signal Word:
Danger
UN#:
2922
Hazard Statements:
H311-H302-H314-H317-H341-H411
Precautionary Statements:
P501-P273-P272-P260-P270-P202-P201-P264-P280-P391-P308+P313-P361+P364-P303+P361+P353-P333+P313-P301+P330+P331-P301+P312+P330-P304+P340+P310-P305+P351+P338+P310-P405
Class:
8,6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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