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163810-26-2 | 2-Oxazolidinone, 3-(4-methyl-1-oxopentyl)-4-(phenylmethyl)-, (4R)-
CAS No: 163810-26-2 Catalog No: AG001UEB MDL No:
Product Description
Catalog Number:
AG001UEB
Chemical Name:
2-Oxazolidinone, 3-(4-methyl-1-oxopentyl)-4-(phenylmethyl)-, (4R)-
CAS Number:
163810-26-2
Molecular Formula:
C16H21NO3
Molecular Weight:
275.3428
IUPAC Name:
(4R)-4-benzyl-3-(4-methylpentanoyl)-1,3-oxazolidin-2-one
InChI:
InChI=1S/C16H21NO3/c1-12(2)8-9-15(18)17-14(11-20-16(17)19)10-13-6-4-3-5-7-13/h3-7,12,14H,8-11H2,1-2H3/t14-/m1/s1
InChI Key:
YYUTVRHBEQTSJS-CQSZACIVSA-N
SMILES:
CC(CCC(=O)N1C(=O)OC[C@H]1Cc1ccccc1)C
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
275.152g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.348g/mol
Monoisotopic Mass:
275.152g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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