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188730-94-1

188730-94-1 | Oxirane, 2-[3-nitro-4-(phenylmethoxy)phenyl]-, (2R)-

CAS No: 188730-94-1 Catalog No: AG002H8X MDL No:

Product Description

Catalog Number:
AG002H8X
Chemical Name:
Oxirane, 2-[3-nitro-4-(phenylmethoxy)phenyl]-, (2R)-
CAS Number:
188730-94-1
Molecular Formula:
C15H13NO4
Molecular Weight:
271.2680
IUPAC Name:
(2R)-2-(3-nitro-4-phenylmethoxyphenyl)oxirane
InChI:
InChI=1S/C15H13NO4/c17-16(18)13-8-12(15-10-20-15)6-7-14(13)19-9-11-4-2-1-3-5-11/h1-8,15H,9-10H2/t15-/m0/s1
InChI Key:
MOGUBMMGIJLRHQ-HNNXBMFYSA-N
SMILES:
[O-][N+](=O)c1cc(ccc1OCc1ccccc1)[C@@H]1CO1

Properties

Complexity:
337  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
271.084g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.272g/mol
Monoisotopic Mass:
271.084g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

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