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Home > Nitro Compounds > 160912-89-0
160912-89-0 | Oxirane, 2-[(1E)-2-(2-nitrophenyl)ethenyl]-
CAS No: 160912-89-0 Catalog No: AG001VHR MDL No:
Product Description
Catalog Number:
AG001VHR
Chemical Name:
Oxirane, 2-[(1E)-2-(2-nitrophenyl)ethenyl]-
CAS Number:
160912-89-0
Molecular Formula:
C10H9NO3
Molecular Weight:
191.1834
IUPAC Name:
2-[2-(2-nitrophenyl)ethenyl]oxirane
InChI:
InChI=1S/C10H9NO3/c12-11(13)10-4-2-1-3-8(10)5-6-9-7-14-9/h1-6,9H,7H2
InChI Key:
KTVQRVCLLYIOCV-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccccc1/C=C/C1CO1
Properties
Complexity:
246
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.058g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
191.186g/mol
Monoisotopic Mass:
191.058g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
58.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
1
XLogP3:
1.6
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