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426463-09-4

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Basic Information
CAS No.: 426463-09-4
Name: 2-CHLORO-5-IODO-PYRIDIN-3-YLAMINE
Article Data: 4
Molecular Structure:
Molecular Structure of 426463-09-4 (2-CHLORO-5-IODO-PYRIDIN-3-YLAMINE)
Formula: C5H4ClIN2
Molecular Weight: 254.458
Synonyms: 2-Chloro-5-iodopyridin-3-amine;
Density: 2.139 g/cm3
Melting Point: 128-133°C
Boiling Point: 352.5 °C at 760 mmHg
Flash Point: 167 °C
Hazard Symbols: Xn
Risk Codes: 22-41
Safety: 26-39
PSA: 38.91000
LogP: 2.50300
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Specification

The 3-Pyridinamine, 2-chloro-5-iodo-, with the CAS registry number of 426463-09-4, is also known as 2-Chloro-5-iodo-pyridin-3-ylamine. It belongs to the product category of Pharmacetical. This chemical's molecular formula is C5H4ClIN2 and molecular weight is 254.46. What's more, its IUPAC name is 2-Chloro-5-iodopyridin-3-amine.

Physical properties about 3-Pyridinamine, 2-chloro-5-iodo- are: (1)ACD/LogP: 2.81; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.81; (4)ACD/LogD (pH 7.4): 2.81; (5)ACD/BCF (pH 5.5): 79.94; (6)ACD/BCF (pH 7.4): 79.94; (7)ACD/KOC (pH 5.5): 800.97; (8)ACD/KOC (pH 7.4): 800.98; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 16.13 Å2; (13)Index of Refraction: 1.707; (14)Molar Refractivity: 46.38 cm3; (15)Molar Volume: 118.9 cm3; (16)Surface Tension: 65.7 dyne/cm; (17)Density: 2.139 g/cm3; (18)Flash Point: 167 °C; (19)Enthalpy of Vaporization: 59.74 kJ/mol; (20)Boiling Point: 352.5 °C at 760 mmHg; (21)Vapour Pressure: 3.81E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Ic1cnc(Cl)c(N)c1
(2) InChI: InChI=1/C5H4ClIN2/c6-5-4(8)1-3(7)2-9-5/h1-2H,8H2
(3) InChIKey: CIKQIWYGYUILOL-UHFFFAOYAV