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Home > Nitro Compounds > 114461-92-6
114461-92-6 | Diazene, (2-methoxyphenyl)(2-nitrophenyl)- (9CI)
CAS No: 114461-92-6 Catalog No: AG000EFS MDL No:
Product Description
Catalog Number:
AG000EFS
Chemical Name:
Diazene, (2-methoxyphenyl)(2-nitrophenyl)- (9CI)
CAS Number:
114461-92-6
Molecular Formula:
C13H11N3O3
Molecular Weight:
257.2447
IUPAC Name:
(2-methoxyphenyl)-(2-nitrophenyl)diazene
InChI:
InChI=1S/C13H11N3O3/c1-19-13-9-5-3-7-11(13)15-14-10-6-2-4-8-12(10)16(17)18/h2-9H,1H3
InChI Key:
ZIQZVWYAZWTQPW-UHFFFAOYSA-N
SMILES:
COc1ccccc1N=Nc1ccccc1[N+](=O)[O-]
Properties
Complexity:
330
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.08g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.249g/mol
Monoisotopic Mass:
257.08g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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