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Home > Nitro Compounds > 159092-67-8
159092-67-8 | Phenanthrene, 1,6-dinitro-
CAS No: 159092-67-8 Catalog No: AG001QG9 MDL No:
Product Description
Catalog Number:
AG001QG9
Chemical Name:
Phenanthrene, 1,6-dinitro-
CAS Number:
159092-67-8
Molecular Formula:
C14H8N2O4
Molecular Weight:
268.2243
IUPAC Name:
1,6-dinitrophenanthrene
InChI:
InChI=1S/C14H8N2O4/c17-15(18)10-6-4-9-5-7-12-11(13(9)8-10)2-1-3-14(12)16(19)20/h1-8H
InChI Key:
GSWPGZWSWHARES-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)c1cccc(c1cc2)[N+](=O)[O-]
Properties
Complexity:
403
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.048g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.228g/mol
Monoisotopic Mass:
268.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
91.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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