200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 130570-45-5
130570-45-5 | Benzene, 1-ethoxy-4-nitro-3-(2-nitroethenyl)-2-(phenylmethoxy)-
CAS No: 130570-45-5 Catalog No: AG000UMY MDL No:
Product Description
Catalog Number:
AG000UMY
Chemical Name:
Benzene, 1-ethoxy-4-nitro-3-(2-nitroethenyl)-2-(phenylmethoxy)-
CAS Number:
130570-45-5
Molecular Formula:
C17H16N2O6
Molecular Weight:
344.3187
IUPAC Name:
1-ethoxy-4-nitro-3-[(E)-2-nitroethenyl]-2-phenylmethoxybenzene
InChI:
InChI=1S/C17H16N2O6/c1-2-24-16-9-8-15(19(22)23)14(10-11-18(20)21)17(16)25-12-13-6-4-3-5-7-13/h3-11H,2,12H2,1H3/b11-10+
InChI Key:
JSKVEFJTWHCZCK-ZHACJKMWSA-N
SMILES:
CCOc1ccc(c(c1OCc1ccccc1)C=C[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
467
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
344.101g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
344.323g/mol
Monoisotopic Mass:
344.101g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.