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655234-59-6 | 2-Oxazolidinone, 3-[(2R)-2-methyl-1-oxooctyl]-4-(phenylmethyl)-, (4R)-
CAS No: 655234-59-6 Catalog No: AG006PHC MDL No:
Product Description
Catalog Number:
AG006PHC
Chemical Name:
2-Oxazolidinone, 3-[(2R)-2-methyl-1-oxooctyl]-4-(phenylmethyl)-, (4R)-
CAS Number:
655234-59-6
Molecular Formula:
C19H27NO3
Molecular Weight:
317.4226
IUPAC Name:
(4R)-4-benzyl-3-[(2R)-2-methyloctanoyl]-1,3-oxazolidin-2-one
InChI:
InChI=1S/C19H27NO3/c1-3-4-5-7-10-15(2)18(21)20-17(14-23-19(20)22)13-16-11-8-6-9-12-16/h6,8-9,11-12,15,17H,3-5,7,10,13-14H2,1-2H3/t15-,17-/m1/s1
InChI Key:
BXXWQQNFXCTKNV-NVXWUHKLSA-N
SMILES:
CCCCCC[C@H](C(=O)N1C(=O)OC[C@H]1Cc1ccccc1)C
Properties
Complexity:
390
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
317.199g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
317.429g/mol
Monoisotopic Mass:
317.199g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.3
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