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Name |
Pyrimidine,2-chloro-5-pentyl- |
EINECS | N/A |
CAS No. | 154466-62-3 | Density | 1.085 g/cm3 |
PSA | 25.78000 | LogP | 2.86270 |
Solubility | N/A | Melting Point |
N/A |
Formula | C9H13ClN2 | Boiling Point | 293.8 °C at 760 mmHg |
Molecular Weight | 184.669 | Flash Point | 159.4 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | 22 | |
Molecular Structure | Hazard Symbols | Xn | |
Synonyms |
2-Chloro-5-n-pentylpyrimidine;2-Chloro-5-pentylpyrimidine; |
Article Data | 3 |
The Pyrimidine,2-chloro-5-pentyl-, with the CAS registry number 154466-62-3, belongs to the product categories of APIs & Intermediate; Pyrimidine. This chemical's molecular formula is C9H13ClN2 and molecular weight is 184.6659. Its systematic name is called 2-chloro-5-pentylpyrimidine. The product should be sealed and stored in cool, dry and well-ventilated place.
Physical properties of Pyrimidine,2-chloro-5-pentyl-: (1)ACD/LogP: 2.95; (2)ACD/LogD (pH 5.5): 2.95; (3)ACD/LogD (pH 7.4): 2.95; (4)ACD/BCF (pH 5.5): 101.99; (5)ACD/BCF (pH 7.4): 101.99; (6)ACD/KOC (pH 5.5): 953.54; (7)ACD/KOC (pH 7.4): 953.54; (8)#H bond acceptors: 2; (9)#Freely Rotating Bonds: 4; (10)Index of Refraction: 1.508; (11)Molar Refractivity: 50.77 cm3; (12)Molar Volume: 170.1 cm3; (13)Surface Tension: 39.7 dyne/cm; (14)Density: 1.085 g/cm3; (15)Flash Point: 159.4 °C; (16)Enthalpy of Vaporization: 51.2 kJ/mol; (17)Boiling Point: 293.8 °C at 760 mmHg; (18)Vapour Pressure: 0.00296 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ncc(CCCCC)cn1
(2)InChI: InChI=1/C9H13ClN2/c1-2-3-4-5-8-6-11-9(10)12-7-8/h6-7H,2-5H2,1H3
(3)InChIKey: WMARUIMXVALOMF-UHFFFAOYAG