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CAS No.: | 884495-19-6 |
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Name: | 2-Amino-3-iodo-6-methylpyridine |
Molecular Structure: | |
Formula: | C6H7IN2 |
Molecular Weight: | 234.039 |
Synonyms: | 3-iodo-6-methylpyridin-2-amine; |
Density: | 1.898g/cm3 |
Boiling Point: | 275.874 °C at 760 mmHg |
Flash Point: | 120.645 °C |
PSA: | 38.91000 |
LogP: | 2.15800 |
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The 2-Amino-3-iodo-6-methylpyridine, with CAS registry number 884495-19-6, belongs to the following product categories: (1)Heterocyclic Compounds; (2)Boronic Acid. It has the systematic name of 3-iodo-6-methyl-pyridin-2-amine. And the chemical formula of this chemical is C6H7IN2.
Physical properties of 2-Amino-3-iodo-6-methylpyridine: (1)ACD/LogP: 2.27; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.215; (4)ACD/LogD (pH 7.4): 2.266; (5)ACD/BCF (pH 5.5): 27.636; (6)ACD/BCF (pH 7.4): 31.032; (7)ACD/KOC (pH 5.5): 362.176; (8)ACD/KOC (pH 7.4): 406.686; (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: 1.675; (14)Molar Refractivity: 46.312 cm3; (15)Molar Volume: 123.285 cm3; (16)Polarizability: 18.359×10-24cm3; (17)Surface Tension: 58.193 dyne/cm; (18)Density: 1.898 g/cm3; (19)Flash Point: 120.645 °C; (20)Enthalpy of Vaporization: 51.435 kJ/mol; (21)Boiling Point: 275.874 °C at 760 mmHg; (22)Vapour Pressure: 0.005 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cc1ccc(c(n1)N)I
(2)InChI: InChI=1/C6H7IN2/c1-4-2-3-5(7)6(8)9-4/h2-3H,1H3,(H2,8,9)
(3)InChIKey: QOAIVYVMHSWJDH-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C6H7IN2/c1-4-2-3-5(7)6(8)9-4/h2-3H,1H3,(H2,8,9)
(5)Std. InChIKey: QOAIVYVMHSWJDH-UHFFFAOYSA-N