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Home > Nitro Compounds > 88210-30-4
88210-30-4 | Phenol, 2-nitro-4-[(4-nitrophenyl)azo]-
CAS No: 88210-30-4 Catalog No: AG004BME MDL No:
Product Description
Catalog Number:
AG004BME
Chemical Name:
Phenol, 2-nitro-4-[(4-nitrophenyl)azo]-
CAS Number:
88210-30-4
Molecular Formula:
C12H8N4O5
Molecular Weight:
288.2157
IUPAC Name:
2-nitro-4-[(4-nitrophenyl)diazenyl]phenol
InChI:
InChI=1S/C12H8N4O5/c17-12-6-3-9(7-11(12)16(20)21)14-13-8-1-4-10(5-2-8)15(18)19/h1-7,17H
InChI Key:
BAWPTBACBDHBOR-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(cc1)N=Nc1ccc(c(c1)[N+](=O)[O-])O
Properties
Complexity:
411
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.049g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
288.219g/mol
Monoisotopic Mass:
288.049g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
137A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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