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Home Halogens 2,2,2-trichloro-N-(1,3-thiazol-2-yl)acetamide

2,2,2-trichloro-N-(1,3-thiazol-2-yl)acetamide

CAS No.:
53399-01-2
Catalog Number:
AG019MTA
Molecular Formula:
C5H3Cl3N2OS
Molecular Weight:
245.5141
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Product Description
Catalog Number:
AG019MTA
Chemical Name:
2,2,2-trichloro-N-(1,3-thiazol-2-yl)acetamide
CAS Number:
53399-01-2
Molecular Formula:
C5H3Cl3N2OS
Molecular Weight:
245.5141
MDL Number:
MFCD00520427
IUPAC Name:
2,2,2-trichloro-N-(1,3-thiazol-2-yl)acetamide
InChI:
InChI=1S/C5H3Cl3N2OS/c6-5(7,8)3(11)10-4-9-1-2-12-4/h1-2H,(H,9,10,11)
InChI Key:
KWVAHFLPHCQYDT-UHFFFAOYSA-N
SMILES:
O=C(C(Cl)(Cl)Cl)Nc1nccs1
Properties
Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.903g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
245.502g/mol
Monoisotopic Mass:
243.903g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
70.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
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
Properties