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1379312-60-3 | 2-(2-Chloro-5-thenoyl)thiazole
CAS No: 1379312-60-3 Catalog No: AG01FF1Z MDL No:
Product Description
Catalog Number:
AG01FF1Z
Chemical Name:
2-(2-Chloro-5-thenoyl)thiazole
CAS Number:
1379312-60-3
Molecular Formula:
C8H4ClNOS2
Molecular Weight:
229.7065
IUPAC Name:
(5-chlorothiophen-2-yl)-(1,3-thiazol-2-yl)methanone
InChI:
InChI=1S/C8H4ClNOS2/c9-6-2-1-5(13-6)7(11)8-10-3-4-12-8/h1-4H
InChI Key:
GUDHMDXVPXFKCC-UHFFFAOYSA-N
SMILES:
Clc1ccc(s1)C(=O)c1nccs1
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.942g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
229.696g/mol
Monoisotopic Mass:
228.942g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
86.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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