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1353970-88-3 | 2-Chloro-N-(2-oxo-2-thiazol-2-yl-ethyl)-acetamide
CAS No: 1353970-88-3 Catalog No: AG01F99Q MDL No:
Product Description
Catalog Number:
AG01F99Q
Chemical Name:
2-Chloro-N-(2-oxo-2-thiazol-2-yl-ethyl)-acetamide
CAS Number:
1353970-88-3
Molecular Formula:
C7H7ClN2O2S
Molecular Weight:
218.6607
IUPAC Name:
2-chloro-N-[2-oxo-2-(1,3-thiazol-2-yl)ethyl]acetamide
InChI:
InChI=1S/C7H7ClN2O2S/c8-3-6(12)10-4-5(11)7-9-1-2-13-7/h1-2H,3-4H2,(H,10,12)
InChI Key:
UUKLOZPWJDHEEB-UHFFFAOYSA-N
SMILES:
ClCC(=O)NCC(=O)c1nccs1
Properties
Complexity:
213
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.992g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
218.655g/mol
Monoisotopic Mass:
217.992g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
87.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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