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2103-98-2 | 2(3H)-Thiazolone, 4-(4-chlorophenyl)-
CAS No: 2103-98-2 Catalog No: AG002KOJ MDL No:MFCD02089965
Product Description
Catalog Number:
AG002KOJ
Chemical Name:
2(3H)-Thiazolone, 4-(4-chlorophenyl)-
CAS Number:
2103-98-2
Molecular Formula:
C9H6ClNOS
Molecular Weight:
211.6680
MDL Number:
MFCD02089965
IUPAC Name:
4-(4-chlorophenyl)-3H-1,3-thiazol-2-one
InChI:
InChI=1S/C9H6ClNOS/c10-7-3-1-6(2-4-7)8-5-13-9(12)11-8/h1-5H,(H,11,12)
InChI Key:
XODFWCAVOQHJFC-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1csc(=O)[nH]1
NSC Number:
55674
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.986g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.663g/mol
Monoisotopic Mass:
210.986g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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