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181017-76-5 | 2-Oxazolidinone, 4,4-dimethyl-5-methylene-3-(phenylmethyl)-
CAS No: 181017-76-5 Catalog No: AG0022M9 MDL No:
Product Description
Catalog Number:
AG0022M9
Chemical Name:
2-Oxazolidinone, 4,4-dimethyl-5-methylene-3-(phenylmethyl)-
CAS Number:
181017-76-5
Molecular Formula:
C13H15NO2
Molecular Weight:
217.2637
IUPAC Name:
3-benzyl-4,4-dimethyl-5-methylidene-1,3-oxazolidin-2-one
InChI:
InChI=1S/C13H15NO2/c1-10-13(2,3)14(12(15)16-10)9-11-7-5-4-6-8-11/h4-8H,1,9H2,2-3H3
InChI Key:
BZXFFYZFEOFJKW-UHFFFAOYSA-N
SMILES:
O=C1OC(=C)C(N1Cc1ccccc1)(C)C
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.11g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
217.268g/mol
Monoisotopic Mass:
217.11g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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