200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 78038-42-3
78038-42-3 | Oxirane, (4-nitrophenyl)-, (2S)-
CAS No: 78038-42-3 Catalog No: AG008NR5 MDL No:MFCD09265207
Product Description
Catalog Number:
AG008NR5
Chemical Name:
Oxirane, (4-nitrophenyl)-, (2S)-
CAS Number:
78038-42-3
Molecular Formula:
C8H7NO3
Molecular Weight:
165.1461
MDL Number:
MFCD09265207
IUPAC Name:
(2S)-2-(4-nitrophenyl)oxirane
InChI:
InChI=1S/C8H7NO3/c10-9(11)7-3-1-6(2-4-7)8-5-12-8/h1-4,8H,5H2/t8-/m1/s1
InChI Key:
YKIUTLHCSNCTDZ-MRVPVSSYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)[C@@H]1OC1
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
165.043g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.148g/mol
Monoisotopic Mass:
165.043g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
58.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.