CAS No.405103-02-8,3-PYRIDINAMINE, 6-(1-METHYLETHYL)- Suppliers

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Basic Information

Molecular Structure:
CAS No.:	405103-02-8
Name:	3-PYRIDINAMINE, 6-(1-METHYLETHYL)-
Article Data:	5

Formula:	C₈H₁₂N₂
Molecular Weight:	136.197
Synonyms:	2-Isopropyl-5-aminopyridine;6-Isopropylpyridin-3-amine;
Density:	1.009 g/cm³
Boiling Point:	255.135 °C at 760 mmHg
Flash Point:	131.787 °C
PSA:	38.91000
LogP:	2.36840

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Specification

The 3-Amino-6-isopropylpyridine, with the CAS registry number 405103-02-8, is also known as 3-Pyridinamine, 6-(1-methylethyl)-. It belongs to the product categories of Pyridine; Pyridines. This chemical's molecular formula is C₈H₁₂N₂ and molecular weight is 136.19. Its IUPAC name is called 6-propan-2-ylpyridin-3-amine.

Physical properties of 3-Amino-6-isopropylpyridine: (1)ACD/LogP: 1.21; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.47; (4)ACD/LogD (pH 7.4): 1.185; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 4.623; (7)ACD/KOC (pH 5.5): 19.744; (8)ACD/KOC (pH 7.4): 102.493; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 2; (12)Index of Refraction: 1.546; (13)Molar Refractivity: 42.765 cm³; (14)Molar Volume: 135.01 cm³; (15)Surface Tension: 41.32 dyne/cm; (16)Density: 1.009 g/cm³; (17)Flash Point: 131.787 °C; (18)Enthalpy of Vaporization: 49.259 kJ/mol; (19)Boiling Point: 255.135 °C at 760 mmHg; (20)Vapour Pressure: 0.017 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(C)C1=NC=C(C=C1)N
(2)InChI: InChI=1S/C8H12N2/c1-6(2)8-4-3-7(9)5-10-8/h3-6H,9H2,1-2H3
(3)InChIKey: XYGFISRAXLLACA-UHFFFAOYSA-N