200,000+ products from a single source!
sales@angenechem.com
Home > Nitro Compounds > 13118-94-0
13118-94-0 | Benzene, 1,3-bis(4-nitrophenoxy)-
CAS No: 13118-94-0 Catalog No: AG000VOE MDL No:
Product Description
Catalog Number:
AG000VOE
Chemical Name:
Benzene, 1,3-bis(4-nitrophenoxy)-
CAS Number:
13118-94-0
Molecular Formula:
C18H12N2O6
Molecular Weight:
352.2977
IUPAC Name:
1,3-bis(4-nitrophenoxy)benzene
InChI:
InChI=1S/C18H12N2O6/c21-19(22)13-4-8-15(9-5-13)25-17-2-1-3-18(12-17)26-16-10-6-14(7-11-16)20(23)24/h1-12H
InChI Key:
GGQPNVUCTKRSFS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)Oc1cccc(c1)Oc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
433
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
352.07g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
352.302g/mol
Monoisotopic Mass:
352.07g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.2
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.