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371227-48-4 | [3-(2-phenylethyl)-1,2-oxazol-5-yl]methanol
CAS No: 371227-48-4 Catalog No: AG01AUCR MDL No:MFCD19666786
Product Description
Catalog Number:
AG01AUCR
Chemical Name:
[3-(2-phenylethyl)-1,2-oxazol-5-yl]methanol
CAS Number:
371227-48-4
Molecular Formula:
C12H13NO2
Molecular Weight:
203.2371
MDL Number:
MFCD19666786
IUPAC Name:
[3-(2-phenylethyl)-1,2-oxazol-5-yl]methanol
InChI:
InChI=1S/C12H13NO2/c14-9-12-8-11(13-15-12)7-6-10-4-2-1-3-5-10/h1-5,8,14H,6-7,9H2
InChI Key:
SWTNBQGKLVJGRU-UHFFFAOYSA-N
SMILES:
OCc1onc(c1)CCc1ccccc1
Properties
Complexity:
181
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:
4
Topological Polar Surface Area:
46.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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