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83631-55-4 | 5-PHENYLTHIAZOL-2-OL
CAS No: 83631-55-4 Catalog No: AG00GK9S MDL No:MFCD09835022
Product Description
Catalog Number:
AG00GK9S
Chemical Name:
5-PHENYLTHIAZOL-2-OL
CAS Number:
83631-55-4
Molecular Formula:
C9H7NOS
Molecular Weight:
177.2230
MDL Number:
MFCD09835022
IUPAC Name:
5-phenyl-3H-1,3-thiazol-2-one
InChI:
InChI=1S/C9H7NOS/c11-9-10-6-8(12-9)7-4-2-1-3-5-7/h1-6H,(H,10,11)
InChI Key:
JGLDQLVRYJRBBW-UHFFFAOYSA-N
SMILES:
O=c1[nH]cc(s1)c1ccccc1
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.025g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.221g/mol
Monoisotopic Mass:
177.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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