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CAS No.: | 36340-61-1 |
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Name: | 2-Amino-4-chloro-6-picoline |
Molecular Structure: | |
Formula: | C6H7ClN2 |
Molecular Weight: | 142.588 |
Synonyms: | 2-Picoline,6-amino-4-chloro- (7CI);2-Amino-4-chloro-6-methylpyridine;2-pyridinamine, 4-chloro-6-methyl-; |
Density: | 1.26 g/cm3 |
Melting Point: | 108-109 °C |
Boiling Point: | 245.1 °C at 760 mmHg |
Flash Point: | 102 °C |
PSA: | 38.91000 |
LogP: | 2.20680 |
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The 2-Amino-4-chloro-6-picoline, with the cas registry number 36340-61-1, has the systematic name of 4-chloro-6-methylpyridin-2-amine. And the molecular formula of the chemical is C6H7ClN2.
The characteristics of this chemical are as followings: (1)ACD/LogP: 1.81; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.22; (4)ACD/LogD (pH 7.4): 1.79; (5)ACD/BCF (pH 5.5): 3.63; (6)ACD/BCF (pH 7.4): 13.4; (7)ACD/KOC (pH 5.5): 59.77; (8)ACD/KOC (pH 7.4): 220.87; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 38.91 Å2; (13)Index of Refraction: 1.592; (14)Molar Refractivity: 38.3 cm3; (15)Molar Volume: 113.1 cm3; (16)Polarizability: 15.18×10-24cm3; (17)Surface Tension: 49.9 dyne/cm; (18)Density: 1.26 g/cm3; (19)Flash Point: 102 °C; (20)Enthalpy of Vaporization: 48.22 kJ/mol; (21)Boiling Point: 245.1 °C at 760 mmHg; (22)Vapour Pressure: 0.0293 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Cc1cc(Cl)cc(N)n1
(2)InChI: InChI=1/C6H7ClN2/c1-4-2-5(7)3-6(8)9-4/h2-3H,1H3,(H2,8,9)
(3)InChIKey: IKKMKJOVXQEEHS-UHFFFAOYAT