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Home > Nitro Compounds > 88210-32-6
88210-32-6 | Phenol, 4-[(2,4-dinitrophenyl)azo]-3-nitro-
CAS No: 88210-32-6 Catalog No: AG004DVV MDL No:
Product Description
Catalog Number:
AG004DVV
Chemical Name:
Phenol, 4-[(2,4-dinitrophenyl)azo]-3-nitro-
CAS Number:
88210-32-6
Molecular Formula:
C12H7N5O7
Molecular Weight:
333.2133
IUPAC Name:
4-[(2,4-dinitrophenyl)diazenyl]-3-nitrophenol
InChI:
InChI=1S/C12H7N5O7/c18-8-2-4-10(12(6-8)17(23)24)14-13-9-3-1-7(15(19)20)5-11(9)16(21)22/h1-6,18H
InChI Key:
PYZWXRIXUFEBCD-UHFFFAOYSA-N
SMILES:
Oc1ccc(c(c1)[N+](=O)[O-])N=Nc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
525
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.035g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
333.216g/mol
Monoisotopic Mass:
333.035g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
182A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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