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Home > Nitro Compounds > 83257-94-7
83257-94-7 | Ethanol, 2,2'-[(3,5-dinitro-1,2-phenylene)bis(oxy)]bis-
CAS No: 83257-94-7 Catalog No: AG004U96 MDL No:
Product Description
Catalog Number:
AG004U96
Chemical Name:
Ethanol, 2,2'-[(3,5-dinitro-1,2-phenylene)bis(oxy)]bis-
CAS Number:
83257-94-7
Molecular Formula:
C10H12N2O8
Molecular Weight:
288.2109
IUPAC Name:
2-[2-(2-hydroxyethoxy)-3,5-dinitrophenoxy]ethanol
InChI:
InChI=1S/C10H12N2O8/c13-1-3-19-9-6-7(11(15)16)5-8(12(17)18)10(9)20-4-2-14/h5-6,13-14H,1-4H2
InChI Key:
KAPNPRDCACYGSO-UHFFFAOYSA-N
SMILES:
OCCOc1cc(cc(c1OCCO)[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
328
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.059g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
288.212g/mol
Monoisotopic Mass:
288.059g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
151A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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