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82191-11-5 | 3-(2-Hydroxy-2-phenylethyl)-1,3-oxazolidin-2-one
CAS No: 82191-11-5 Catalog No: AG00ID8B MDL No:MFCD16042772
Product Description
Catalog Number:
AG00ID8B
Chemical Name:
3-(2-Hydroxy-2-phenylethyl)-1,3-oxazolidin-2-one
CAS Number:
82191-11-5
Molecular Formula:
C11H13NO3
Molecular Weight:
207.2258
MDL Number:
MFCD16042772
IUPAC Name:
3-(2-hydroxy-2-phenylethyl)-1,3-oxazolidin-2-one
InChI:
InChI=1S/C11H13NO3/c13-10(9-4-2-1-3-5-9)8-12-6-7-15-11(12)14/h1-5,10,13H,6-8H2
InChI Key:
XAINKWDKGNVXFB-UHFFFAOYSA-N
SMILES:
OC(c1ccccc1)CN1CCOC1=O
Properties
Complexity:
226
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
207.09g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
207.229g/mol
Monoisotopic Mass:
207.09g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
49.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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