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Home > Nitro Compounds > 7505-72-8
7505-72-8 | DIHYDROXY-OXO-AZANIUM; METHYL-TRIS(3-NITROPHENYL)ARSANIUM
CAS No: 7505-72-8 Catalog No: AG005R0B MDL No:
Product Description
Catalog Number:
AG005R0B
Chemical Name:
DIHYDROXY-OXO-AZANIUM; METHYL-TRIS(3-NITROPHENYL)ARSANIUM
CAS Number:
7505-72-8
Molecular Formula:
C19H17AsN4O9++
Molecular Weight:
520.2813
IUPAC Name:
dihydroxy(oxo)azanium;methyl-tris(3-nitrophenyl)arsanium
InChI:
InChI=1S/C19H15AsN3O6.H2NO3/c1-20(14-5-2-8-17(11-14)21(24)25,15-6-3-9-18(12-15)22(26)27)16-7-4-10-19(13-16)23(28)29;2-1(3)4/h2-13H,1H3;(H2,2,3,4)/q2*+1
InChI Key:
QWHVMFPDLILGAG-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)[As+](c1cccc(c1)[N+](=O)[O-])(c1cccc(c1)[N+](=O)[O-])C.O[N+](=O)O
Properties
Complexity:
574
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
520.021g/mol
Formal Charge:
2
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
520.286g/mol
Monoisotopic Mass:
520.021g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
198A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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