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Home > Nitro Compounds > 189350-25-2
189350-25-2 | 2-Oxazolidinone, 3-[(1S)-2-nitro-1-phenylethyl]-4-phenyl-, (4S)-
CAS No: 189350-25-2 Catalog No: AG002ICM MDL No:
Product Description
Catalog Number:
AG002ICM
Chemical Name:
2-Oxazolidinone, 3-[(1S)-2-nitro-1-phenylethyl]-4-phenyl-, (4S)-
CAS Number:
189350-25-2
Molecular Formula:
C17H16N2O4
Molecular Weight:
312.3199
IUPAC Name:
(4S)-3-[(1S)-2-nitro-1-phenylethyl]-4-phenyl-1,3-oxazolidin-2-one
InChI:
InChI=1S/C17H16N2O4/c20-17-19(16(12-23-17)14-9-5-2-6-10-14)15(11-18(21)22)13-7-3-1-4-8-13/h1-10,15-16H,11-12H2/t15-,16-/m1/s1
InChI Key:
TXXQPNWGTWILFL-HZPDHXFCSA-N
SMILES:
[O-][N+](=O)C[C@@H](N1C(=O)OC[C@@H]1c1ccccc1)c1ccccc1
Properties
Complexity:
425
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
312.111g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
312.325g/mol
Monoisotopic Mass:
312.111g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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