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Pyrimidine,4-chloro-6-phenoxy-

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Name

Pyrimidine,4-chloro-6-phenoxy-

EINECS N/A
CAS No. 124041-00-5 Density 1.304 g/cm3
PSA 35.01000 LogP 2.92230
Solubility N/A Melting Point 33-35 °C(Solv: hexane (110-54-3))
Formula C10H7ClN2O Boiling Point 317.884 °C at 760 mmHg
Molecular Weight 206.6284 Flash Point 146.051 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 124041-00-5 (4-PHENOXY-6-CHLOROPYRIMIDINE) Hazard Symbols N/A
Synonyms

4-Chloro-6-phenoxypyrimidine;4-Phenoxy-6-chloropyrimidine;4-chloro-6-phenoxypyrimidine;pyrimidine, 4-chloro-6-phenoxy-;

Article Data 2

Pyrimidine,4-chloro-6-phenoxy- Specification

The Pyrimidine,4-chloro-6-phenoxy-, with the CAS registry number 124041-00-5, has the systematic name of 4-chloro-6-phenoxypyrimidine. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C10H7ClN2O.

The characteristics of Pyrimidine,4-chloro-6-phenoxy- are as followings: (1)ACD/LogP: 3.00; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 35.01 Å2; (7)Index of Refraction: 1.594; (8)Molar Refractivity: 53.774 cm3; (9)Molar Volume: 158.419 cm3; (10)Polarizability: 21.318×10-24cm3; (11)Surface Tension: 50.622 dyne/cm; (12)Density: 1.304 g/cm3; (13)Flash Point: 146.051 °C; (14)Enthalpy of Vaporization: 53.707 kJ/mol; (15)Boiling Point: 317.884 °C at 760 mmHg; (16)Vapour Pressure: 0.001 mmHg at 25°C. 

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Clc2ncnc(Oc1ccccc1)c2
(2)InChI: InChI=1/C10H7ClN2O/c11-9-6-10(13-7-12-9)14-8-4-2-1-3-5-8/h1-7H
(3)InChIKey: KHGWFZBIISKKRP-UHFFFAOYAF

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