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Home > Nitro Compounds > 63909-38-6
63909-38-6 | (E);-1-(Benzyloxy);-2-methoxy-4-(2-nitrovinyl);benzene
CAS No: 63909-38-6 Catalog No: AG003KTE MDL No:
Product Description
Catalog Number:
AG003KTE
Chemical Name:
(E);-1-(Benzyloxy);-2-methoxy-4-(2-nitrovinyl);benzene
CAS Number:
63909-38-6
Molecular Formula:
C16H15NO4
Molecular Weight:
285.2946
IUPAC Name:
2-methoxy-4-[(E)-2-nitroethenyl]-1-phenylmethoxybenzene
InChI:
InChI=1S/C16H15NO4/c1-20-16-11-13(9-10-17(18)19)7-8-15(16)21-12-14-5-3-2-4-6-14/h2-11H,12H2,1H3/b10-9+
InChI Key:
YDGNRJKNDGBMCL-MDZDMXLPSA-N
SMILES:
COc1cc(ccc1OCc1ccccc1)/C=C/[N+](=O)[O-]
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
285.1g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
285.299g/mol
Monoisotopic Mass:
285.1g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
64.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
Literature
| Title | Journal |
|---|---|
| E-Combretastatin and E-resveratrol structural modifications: antimicrobial and cancer cell growth inhibitory beta-E-nitrostyrenes. | Bioorganic & medicinal chemistry 20090915 |
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