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Hydrazinecarboximidamide,2-(3-pyridinylmethylene)-, hydrochloride (1:2) 5462-51-1 98%
【Name】
Hydrazinecarboximidamide,2-(3-pyridinylmethylene)-, hydrochloride (1:2)
【CAS Registry number】
5462-51-1
【Synonyms】
Guanidine,[(3-pyridylmethylene)amino]-, dihydrochloride (7CI,8CI)
Nicotinaldehyde,amidinohydrazone, dihydrochloride
【Molecular Formula】
C7H9 N5 . 2 Cl H (Products with the same molecular formula)
【Molecular Weight】
163.1799
【Inchi】
InChI=1/C7H9N5/c8-7(9)12-11-5-6-2-1-3-10-4-6/h1-5H,(H4,8,9,12)/b11-5+
【Canonical SMILES】
C1=CC(=CN=C1)C=NN=C(N)N.[Cl-]
【Isomers smiles】
C1=CC(=CN=C1)/C=N/N=C(N)N.[Cl-]
Chemical and Physical Properties
【Density】
1.312g/cm3
【Boiling Point】
373.619°C at 760 mmHg
【Refractive Index】
1.648
【Flash Point】
179.759°C
【Computed Properties】
Molecular Weight:198.63286 [g/mol]
Molecular Formula:C7H9ClN5-
H-Bond Donor:2
H-Bond Acceptor:4
Rotatable Bond Count:2
Tautomer Count:2
Exact Mass:198.054648
MonoIsotopic Mass:198.054648
Topological Polar Surface Area:89.6
Heavy Atom Count:13
Formal Charge:-1
Complexity:182
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:1
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:2
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