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Home > Nitro Compounds > 28518-99-2
28518-99-2 | Diazene, methoxy(nitrophenyl)- (9CI)
CAS No: 28518-99-2 Catalog No: AG002VLR MDL No:
Product Description
Catalog Number:
AG002VLR
Chemical Name:
Diazene, methoxy(nitrophenyl)- (9CI)
CAS Number:
28518-99-2
Molecular Formula:
C7H7N3O3
Molecular Weight:
181.1488
IUPAC Name:
methoxy-(2-nitrophenyl)diazene
InChI:
InChI=1S/C7H7N3O3/c1-13-9-8-6-4-2-3-5-7(6)10(11)12/h2-5H,1H3
InChI Key:
TZBTYJGIJJJIDH-UHFFFAOYSA-N
SMILES:
CON=Nc1ccccc1[N+](=O)[O-]
Properties
Complexity:
202
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.049g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.151g/mol
Monoisotopic Mass:
181.049g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
79.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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