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Home > Nitro Compounds > 882513-61-3
882513-61-3 | 2,4-Dinitrophenylhydrazine-13C6, Stabilized with Water
CAS No: 882513-61-3 Catalog No: AG004AML MDL No:
Product Description
Catalog Number:
AG004AML
Chemical Name:
2,4-Dinitrophenylhydrazine-13C6, Stabilized with Water
CAS Number:
882513-61-3
Molecular Formula:
C6H6N4O4
Molecular Weight:
204.0922
IUPAC Name:
(2,4-dinitro(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-trien-1-yl)hydrazine
InChI:
InChI=1S/C6H6N4O4/c7-8-5-2-1-4(9(11)12)3-6(5)10(13)14/h1-3,8H,7H2/i1+1,2+1,3+1,4+1,5+1,6+1
InChI Key:
HORQAOAYAYGIBM-IDEBNGHGSA-N
SMILES:
NN[13c]1[13cH][13cH][13c]([13cH][13c]1[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
235
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.059g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
6
Molecular Weight:
204.092g/mol
Monoisotopic Mass:
204.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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