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59398-98-0 | (2-PHENYL-OXAZOL-4-YL)-METHANOL
CAS No: 59398-98-0 Catalog No: AG00E9ZR MDL No:MFCD06738534
Product Description
Catalog Number:
AG00E9ZR
Chemical Name:
(2-PHENYL-OXAZOL-4-YL)-METHANOL
CAS Number:
59398-98-0
Molecular Formula:
C10H9NO2
Molecular Weight:
175.1840
MDL Number:
MFCD06738534
IUPAC Name:
(2-phenyl-1,3-oxazol-4-yl)methanol
InChI:
InChI=1S/C10H9NO2/c12-6-9-7-13-10(11-9)8-4-2-1-3-5-8/h1-5,7,12H,6H2
InChI Key:
FSDBXQYHHCUEIE-UHFFFAOYSA-N
SMILES:
OCc1coc(n1)c1ccccc1
Properties
Complexity:
157
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
175.063g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
175.187g/mol
Monoisotopic Mass:
175.063g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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