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100391-01-3 | 2-Oxazolidinone, 3-ethyl-5-(phenoxymethyl)-
CAS No: 100391-01-3 Catalog No: AG0001VG MDL No:
Product Description
Catalog Number:
AG0001VG
Chemical Name:
2-Oxazolidinone, 3-ethyl-5-(phenoxymethyl)-
CAS Number:
100391-01-3
Molecular Formula:
C12H15NO3
Molecular Weight:
221.2524
IUPAC Name:
3-ethyl-5-(phenoxymethyl)-1,3-oxazolidin-2-one
InChI:
InChI=1S/C12H15NO3/c1-2-13-8-11(16-12(13)14)9-15-10-6-4-3-5-7-10/h3-7,11H,2,8-9H2,1H3
InChI Key:
HRZOYBZKKZKDNY-UHFFFAOYSA-N
SMILES:
CCN1CC(OC1=O)COc1ccccc1
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.105g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.256g/mol
Monoisotopic Mass:
221.105g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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