Piperidin-4-ylmethyl-pyrimidin-2-yl-amine supplier

Name
Piperidin-4-ylmethyl-pyrimidin-2-yl-amine
EINECS
CAS No. 521273-76-7
Article Data2
CAS DataBase
Density 1.106 g/cm³
Solubility
Melting Point 73-75 °C
Formula C₁₀H₁₆N₄
Boiling Point 349.62 °C at 760 mmHg
Molecular Weight 192.264
Flash Point 165.244 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms N-(Piperidin-4-ylmethyl)pyrimidin-2-amine;
PSA 49.84000
LogP 1.28990

Piperidin-4-ylmethyl-pyrimidin-2-yl-amine Specification

The Piperidin-4-ylmethyl-pyrimidin-2-yl-amine, with the CAS registry number 521273-76-7, has the systematic name of N-(piperidin-4-ylmethyl)pyrimidin-2-amine. And the molecular formula of the chemical is C₁₀H₁₆N₄.

The characteristics of Piperidin-4-ylmethyl-pyrimidin-2-yl-amine are as followings: (1)ACD/LogP: 0.51; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 49.84 Å²; (11)Index of Refraction: 1.563; (12)Molar Refractivity: 56.464 cm³; (13)Molar Volume: 173.847 cm³; (14)Polarizability: 22.384×10^-24cm³; (15)Surface Tension: 48.967 dyne/cm; (16)Density: 1.106 g/cm³; (17)Flash Point: 165.244 °C; (18)Enthalpy of Vaporization: 59.413 kJ/mol; (19)Boiling Point: 349.62 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: N(CC1CCNCC1)c2ncccn2
(2)InChI: InChI=1/C10H16N4/c1-4-12-10(13-5-1)14-8-9-2-6-11-7-3-9/h1,4-5,9,11H,2-3,6-8H2,(H,12,13,14)
(3)InChIKey: RYUCGGGAQDYSMJ-UHFFFAOYAQ

Product Name

Piperidin-4-ylmethyl-pyrimidin-2-yl-amine

Piperidin-4-ylmethyl-pyrimidin-2-yl-amine Specification

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