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Home > Nitro Compounds > 14985-26-3
14985-26-3 | Oxirane, 2-(4-nitrophenyl)-3-phenyl-, (2R,3R)-rel-
CAS No: 14985-26-3 Catalog No: AG001M1W MDL No:
Product Description
Catalog Number:
AG001M1W
Chemical Name:
Oxirane, 2-(4-nitrophenyl)-3-phenyl-, (2R,3R)-rel-
CAS Number:
14985-26-3
Molecular Formula:
C14H11NO3
Molecular Weight:
241.2420
IUPAC Name:
(2S,3S)-2-(4-nitrophenyl)-3-phenyloxirane
InChI:
InChI=1S/C14H11NO3/c16-15(17)12-8-6-11(7-9-12)14-13(18-14)10-4-2-1-3-5-10/h1-9,13-14H/t13-,14-/m0/s1
InChI Key:
YUZKNYLREGXARL-KBPBESRZSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)[C@H]1O[C@@H]1c1ccccc1
NSC Number:
66823
Properties
Complexity:
301
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
241.074g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
241.246g/mol
Monoisotopic Mass:
241.074g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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