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1020719-03-2

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Basic Information
CAS No.: 1020719-03-2
Name: 2-Amino-3-[(methyl-d3)amino]-5-phenylpyridine
Molecular Structure:
Molecular Structure of 1020719-03-2 (2-Amino-3-[(methyl-d3)amino]-5-phenylpyridine)
Formula: C12H10D3N3
Molecular Weight: 202.2702
Synonyms: 5-Phenyl-N3-(trideuteriomethyl)pyridine-2,3-diamine;
Density: 1.192 g/cm3
Boiling Point: 383.306 °C at 760 mmHg
Flash Point: 185.617 °C
PSA: 50.94000
LogP: 3.02670
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Specification

The 2-Amino-3-[(methyl-d3)amino]-5-phenylpyridine is an organic compound with the formula C12H10D3N3. The systematic name of this chemical is 5-Phenyl-N3-(trideuteriomethyl)pyridine-2,3-diamine. The CAS registry number of this chemical is 1020719-03-2. Besides, its molecular weight is 202.27.

The physical properties of 2-Amino-3-[(methyl-d3)amino]-5-phenylpyridine are: (1)ACD/LogP: 2.69; (2)ACD/LogD (pH 5.5): 2.167; (3)ACD/LogD (pH 7.4): 2.681; (4)ACD/BCF (pH 5.5): 19.54; (5)ACD/BCF (pH 7.4): 63.736; (6)ACD/KOC (pH 5.5): 207.055; (7)ACD/KOC (pH 7.4): 675.384; (8)#H bond acceptors: 3; (9)#H bond donors: 3; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 50.94 Å2; (12)Index of Refraction: 1.662; (13)Molar Refractivity: 62.782 cm3; (14)Molar Volume: 169.678 cm3; (15)Polarizability: 24.889×10-24 cm3; (16)Surface Tension: 53.784 dyne/cm; (17)Density: 1.192 g/cm3; (18)Flash Point: 185.617 °C; (19)Enthalpy of Vaporization: 63.183 kJ/mol; (20)Boiling Point: 383.306 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: [2H]C([2H])([2H])Nc1cc(cnc1N)c2ccccc2
(2)InChI: InChI=1/C12H13N3/c1-14-11-7-10(8-15-12(11)13)9-5-3-2-4-6-9/h2-8,14H,1H3,(H2,13,15)/i1D3
(3)InChIKey: ZZARKLLLBRWNNV-FIBGUPNXEX
(4)Std. InChI: InChI=1S/C12H13N3/c1-14-11-7-10(8-15-12(11)13)9-5-3-2-4-6-9/h2-8,14H,1H3,(H2,13,15)/i1D3
(5)Std. InChIKey: ZZARKLLLBRWNNV-FIBGUPNXSA-N