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89149-95-1 | 5-Oxazoleethanol, 2-methyl-4-phenyl-
CAS No: 89149-95-1 Catalog No: AG003YSM MDL No:
Product Description
Catalog Number:
AG003YSM
Chemical Name:
5-Oxazoleethanol, 2-methyl-4-phenyl-
CAS Number:
89149-95-1
Molecular Formula:
C12H13NO2
Molecular Weight:
203.2371
IUPAC Name:
2-(2-methyl-4-phenyl-1,3-oxazol-5-yl)ethanol
InChI:
InChI=1S/C12H13NO2/c1-9-13-12(11(15-9)7-8-14)10-5-3-2-4-6-10/h2-6,14H,7-8H2,1H3
InChI Key:
QPKXWZMCORUMPZ-UHFFFAOYSA-N
SMILES:
OCCc1oc(nc1c1ccccc1)C
Properties
Complexity:
192
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.095g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
203.241g/mol
Monoisotopic Mass:
203.095g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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