Product Name: (2-Methyl-5-nitrophenyl)guanidine nitrate
Synonyms of (2-Methyl-5-nitrophenyl)guanidine nitrate (CAS NO.152460-08-7): 2-(2-methyl-5-nitrophenyl)guanidine nitrate (1:1) ; N-(2-Methyl-5-nitrophenyl)guanidine nitrate
CAS NO: 152460-08-7
Molecular Formula: C8H10N4O2.HNO3
Molecular Weight: 257.20
Molecular Structure:
H bond acceptors: 6
H bond donors: 4
Freely Rotating Bonds: 2
Polar Surface Area: 64.66 Å2
Enthalpy of Vaporization: 68.16 kJ/mol
Boiling Point: 426.7 °C at 760 mmHg
Melting Point: 218-219 ºC
Vapour Pressure: 1.73E-07 mmHg at 25°C
SMILES: [O-][N+](=O)O.[O-][N+](=O)c1ccc(c(/N=C(\N)N)c1)C
InChI: InChI=1/C8H10N4O2.HNO3/c1-5-2-3-6(12(13)14)4-7(5)11-8(9)10;2-1(3)4/h2-4H,1H3,(H4,9,10,11);(H,2,3,4)
InChIKey: IINMQQJNRFDBMV-UHFFFAOYAN
Std. InChI: InChI=1S/C8H10N4O2.HNO3/c1-5-2-3-6(12(13)14)4-7(5)11-8(9)10;2-1(3)4/h2-4H,1H3,(H4,9,10,11);(H,2,3,4)
Std. InChIKey: IINMQQJNRFDBMV-UHFFFAOYSA-N
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