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174824-75-0 | Ethanone, 2,2,2-trifluoro-1-(2-thiazolyl)-
CAS No: 174824-75-0 Catalog No: AG001ZZL MDL No:MFCD02260839
Product Description
Catalog Number:
AG001ZZL
Chemical Name:
Ethanone, 2,2,2-trifluoro-1-(2-thiazolyl)-
CAS Number:
174824-75-0
Molecular Formula:
C5H2F3NOS
Molecular Weight:
181.1357
MDL Number:
MFCD02260839
IUPAC Name:
2,2,2-trifluoro-1-(1,3-thiazol-2-yl)ethanone
InChI:
InChI=1S/C5H2F3NOS/c6-5(7,8)3(10)4-9-1-2-11-4/h1-2H
InChI Key:
YLGPWVRFKBVIJC-UHFFFAOYSA-N
SMILES:
O=C(C(F)(F)F)c1nccs1
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.981g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.132g/mol
Monoisotopic Mass:
180.981g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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