2(3H)-Thiazolone, 4-(4-chlorophenyl)-


Chemical Name: 2(3H)-Thiazolone, 4-(4-chlorophenyl)-
CAS Number: 2103-98-2
Product Number: AG002KOJ(AGN-PC-0JOI3S)
Synonyms:
MDL No:
Molecular Formula: C9H6ClNOS
Molecular Weight: 211.6680

Identification/Properties


Computed Properties
Molecular Weight:
211.663g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
210.986g/mol
Monoisotopic Mass:
210.986g/mol
Topological Polar Surface Area:
54.4A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
246
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#:
2811
Hazard Statements:
H301-H315-H318-H335
Precautionary Statements:
P261-P280-P301+P310-P305+P351+P338
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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