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848859-45-0 | 1,3-Benzenediamine, 4-[(2-fluoro-5-nitrophenyl)azo]-
CAS No: 848859-45-0 Catalog No: AG004M98 MDL No:
Product Description
Catalog Number:
AG004M98
Chemical Name:
1,3-Benzenediamine, 4-[(2-fluoro-5-nitrophenyl)azo]-
CAS Number:
848859-45-0
Molecular Formula:
C12H10FN5O2
Molecular Weight:
275.2385
IUPAC Name:
4-[(2-fluoro-5-nitrophenyl)diazenyl]benzene-1,3-diamine
InChI:
InChI=1S/C12H10FN5O2/c13-9-3-2-8(18(19)20)6-12(9)17-16-11-4-1-7(14)5-10(11)15/h1-6H,14-15H2
InChI Key:
YHLKDRKLKDYREE-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)N)N=Nc1cc(ccc1F)[N+](=O)[O-]
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.082g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
275.243g/mol
Monoisotopic Mass:
275.082g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
123A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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