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1353980-05-8 | 2-Chloro-N-(2-chloro-thiazol-5-ylmethyl)-N-methyl-acetamide
CAS No: 1353980-05-8 Catalog No: AG01F6VF MDL No:
Product Description
Catalog Number:
AG01F6VF
Chemical Name:
2-Chloro-N-(2-chloro-thiazol-5-ylmethyl)-N-methyl-acetamide
CAS Number:
1353980-05-8
Molecular Formula:
C7H8Cl2N2OS
Molecular Weight:
239.1222
IUPAC Name:
2-chloro-N-[(2-chloro-1,3-thiazol-5-yl)methyl]-N-methylacetamide
InChI:
InChI=1S/C7H8Cl2N2OS/c1-11(6(12)2-8)4-5-3-10-7(9)13-5/h3H,2,4H2,1H3
InChI Key:
HBUAGWFRJGTACD-UHFFFAOYSA-N
SMILES:
ClCC(=O)N(Cc1cnc(s1)Cl)C
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.973g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.114g/mol
Monoisotopic Mass:
237.973g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
61.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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