Home Halogens Ethanone, 1-(2-bromo-5-thiazolyl)-

Ethanone, 1-(2-bromo-5-thiazolyl)-

CAS No.:
1161776-13-1
Catalog Number:
AG000BTE
Molecular Formula:
C5H4BrNOS
Molecular Weight:
206.0604
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Product Description
Catalog Number:
AG000BTE
Chemical Name:
Ethanone, 1-(2-bromo-5-thiazolyl)-
CAS Number:
1161776-13-1
Molecular Formula:
C5H4BrNOS
Molecular Weight:
206.0604
MDL Number:
MFCD13189989
IUPAC Name:
1-(2-bromo-1,3-thiazol-5-yl)ethanone
InChI:
InChI=1S/C5H4BrNOS/c1-3(8)4-2-7-5(6)9-4/h2H,1H3
InChI Key:
XGHAHIKODQEJTA-UHFFFAOYSA-N
SMILES:
CC(=O)c1cnc(s1)Br
Properties
Complexity:
130  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.92g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.057g/mol
Monoisotopic Mass:
204.92g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties