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208264-53-3 | Ethanone, 1-(4-bromo-2-thiazolyl)-
CAS No: 208264-53-3 Catalog No: AG002JM8 MDL No:MFCD10697512
Product Description
Catalog Number:
AG002JM8
Chemical Name:
Ethanone, 1-(4-bromo-2-thiazolyl)-
CAS Number:
208264-53-3
Molecular Formula:
C5H4BrNOS
Molecular Weight:
206.0604
MDL Number:
MFCD10697512
IUPAC Name:
1-(4-bromo-1,3-thiazol-2-yl)ethanone
InChI:
InChI=1S/C5H4BrNOS/c1-3(8)5-7-4(6)2-9-5/h2H,1H3
InChI Key:
YQJROTDRGHSQNZ-UHFFFAOYSA-N
SMILES:
CC(=O)c1nc(cs1)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
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