Basic information
- Name:
4-Piperidinamine,1-(4-chloro-2-pyrimidinyl)-
- Superlist Name:
- 1-(4-Chloro-pyrimidin-2-yl)-4-piperidinamine
- CAS No.:
596818-00-7
- Molecular Structure:
- Formula:
- C9H13ClN4
- Molecular Weight:
- 212.68
- Synonyms:
- 1-(4-Chloropyrimidin-2-yl)piperidin-4-amine;4-piperidinamine, 1-(4-chloro-2-pyrimidinyl)-;1-(4-Chloro-pyrimidin-2-yl)-4-piperidinamine;
- Density:
- 1.268 g/cm3
- Boiling Point:
- 374.1 °C at 760 mmHg
- Flash Point:
- 180 °C
Famous Chemical Enterprises
-
Livzon -
Total -
Shell -
Dupont -
Exxonmobil -
Akzonobel -
Basf -
Bayer -
BP
Please post your buying leads,so that our qualified suppliers will soon
contact you!
*Required Fields
Specification
The 1-(4-Chloro-pyrimidin-2-yl)-4-piperidinamine, with the CAS registry number 596818-00-7, has the systematic name of 1-(4-chloropyrimidin-2-yl)piperidin-4-amine. And the molecular formula of the chemical is C9H13ClN4.
The characteristics of this chemical are as followings: (1)ACD/LogP: 1.27; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 55.04 Å2; (7)Index of Refraction: 1.578; (8)Molar Refractivity: 55.69 cm3; (9)Molar Volume: 167.6 cm3; (10)Polarizability: 22.08×10-24cm3; (11)Surface Tension: 55 dyne/cm; (12)Density: 1.268 g/cm3; (13)Flash Point: 180 °C; (14)Enthalpy of Vaporization: 62.14 kJ/mol; (15)Boiling Point: 374.1 °C at 760 mmHg; (16)Vapour Pressure: 8.57E-06 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: c1cnc(nc1Cl)N2CCC(CC2)N
(2)InChI: InChI=1/C9H13ClN4/c10-8-1-4-12-9(13-8)14-5-2-7(11)3-6-14/h1,4,7H,2-3,5-6,11H2
(3)InChIKey: TWQNYALLXKLRFY-UHFFFAOYAF
