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1353983-78-4 | 2-Chloro-N-thiazol-5-ylmethyl-acetamide
CAS No: 1353983-78-4 Catalog No: AG01FCC8 MDL No:
Product Description
Catalog Number:
AG01FCC8
Chemical Name:
2-Chloro-N-thiazol-5-ylmethyl-acetamide
CAS Number:
1353983-78-4
Molecular Formula:
C6H7ClN2OS
Molecular Weight:
190.6506
IUPAC Name:
2-chloro-N-(1,3-thiazol-5-ylmethyl)acetamide
InChI:
InChI=1S/C6H7ClN2OS/c7-1-6(10)9-3-5-2-8-4-11-5/h2,4H,1,3H2,(H,9,10)
InChI Key:
QGJGZJLVBLUGTK-UHFFFAOYSA-N
SMILES:
ClCC(=O)NCc1cncs1
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.997g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.645g/mol
Monoisotopic Mass:
189.997g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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