Pyrimidine, 4-chloro-6-(4-iodo-1H-pyrazol-1-yl)- supplier

Name
4-Chloro-6-(4-iodo-1H-pyrazol-1-yl)pyrimidine
EINECS
CAS No. 957035-27-7
Density 2.18 g/cm³
Solubility
Melting Point
Formula C₇H₄ClIN₄
Boiling Point 402.6 °C at 760 mmHg
Molecular Weight 306.4909
Flash Point 197.3 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 4-Chloro-6-(4-iodo-1H-pyrazol-1-yl)pyrimidine;
PSA 43.60000
LogP 1.92030

Pyrimidine, 4-chloro-6-(4-iodo-1H-pyrazol-1-yl)- Specification

The Pyrimidine, 4-chloro-6-(4-iodo-1H-pyrazol-1-yl)-, with the CAS registry number 957035-27-7, is also known as 4-Chloro-6-(4-iodo-1H-pyrazol-1-yl)pyrimidine. It belongs to the product categories of Blocks; Bromides; Imidazoles; Iodides; Pyridines. This chemical's molecular formula is C₇H₄ClIN₄ and molecular weight is 306.4909. What's more, its systematic name is called 4-Chloro-6-(4-iodopyrazol-1-yl)pyrimidine.

Physical properties about this chemical are: (1)ACD/LogP: 2.40; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.4; (4)ACD/LogD (pH 7.4): 2.4; (5)#H bond acceptors: 4; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 1; (8)Polar Surface Area: 43.6 Å²; (9)Index of Refraction: 1.803; (10)Molar Refractivity: 60.07 cm³; (11)Molar Volume: 140 cm³; (12)Polarizability: 23.81×10^-24cm³; (13)Surface Tension: 66.5 dyne/cm; (14)Density: 2.18 g/cm³; (15)Flash Point: 197.3 °C; (16)Enthalpy of Vaporization: 62.83 kJ/mol; (17)Boiling Point: 402.6 °C at 760 mmHg; (18)Vapour Pressure: 2.52E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: c1c(ncnc1Cl)n2cc(cn2)I
(2) InChI: InChI=1/C7H4ClIN4/c8-6-1-7(11-4-10-6)13-3-5(9)2-12-13/h1-4H
(3) InChIKey: SJJALIFOBUEFSW-UHFFFAOYAT

Product Name

4-Chloro-6-(4-iodo-1H-pyrazol-1-yl)pyrimidine

Pyrimidine, 4-chloro-6-(4-iodo-1H-pyrazol-1-yl)- Specification

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