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Home > Fluorides > 1005196-13-3
1005196-13-3 | Thiazole, 2-(4-fluorophenyl)-
CAS No: 1005196-13-3 Catalog No: AG000285 MDL No:MFCD12033576
Product Description
Catalog Number:
AG000285
Chemical Name:
Thiazole, 2-(4-fluorophenyl)-
CAS Number:
1005196-13-3
Molecular Formula:
C9H6FNS
Molecular Weight:
179.2140
MDL Number:
MFCD12033576
IUPAC Name:
2-(4-fluorophenyl)-1,3-thiazole
InChI:
InChI=1S/C9H6FNS/c10-8-3-1-7(2-4-8)9-11-5-6-12-9/h1-6H
InChI Key:
WZAFKSDODCFYPN-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)c1nccs1
Properties
Complexity:
146
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.02g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.212g/mol
Monoisotopic Mass:
179.02g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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