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Name |
5-chloro-3-hydroxymethyl-6-methoxypyridine |
EINECS | N/A |
CAS No. | 132865-53-3 | Density | 1.311 g/cm3 |
PSA | 42.35000 | LogP | 1.23590 |
Solubility | N/A | Melting Point |
N/A |
Formula | C7H8ClNO2 | Boiling Point | 276.435 °C at 760 mmHg |
Molecular Weight | 173.599 | Flash Point | 120.984 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
(5-Chloro-6-methoxypyridin-3-yl)methanol; |
The 5-chloro-3-hydroxymethyl-6-methoxypyridine, with CAS registry number 132865-53-3, belongs to the following product category: Pyridine. It has the systematic name of (5-chloro-6-methoxypyridin-3-yl)methanol. Besides this, it is also called 5-Chloro-3-hydroxymethyl-6-methoxypyridine. And the chemical formula of this chemical is C7H8ClNO2.
Physical properties of 5-chloro-3-hydroxymethyl-6-methoxypyridine: (1)ACD/LogP: 1.34; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 3; (6)ACD/BCF (pH 7.4): 3; (7)ACD/KOC (pH 5.5): 77; (8)ACD/KOC (pH 7.4): 77; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 42.35 Å2; (13)Index of Refraction: 1.553; (14)Molar Refractivity: 42.369 cm3; (15)Molar Volume: 132.427 cm3; (16)Polarizability: 16.796×10-24cm3; (17)Surface Tension: 47.416 dyne/cm; (18)Density: 1.311 g/cm3; (19)Flash Point: 120.984 °C; (20)Enthalpy of Vaporization: 54.393 kJ/mol; (21)Boiling Point: 276.435 °C at 760 mmHg; (22)Vapour Pressure: 0.002 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(cnc1OC)CO
(2)InChI: InChI=1/C7H8ClNO2/c1-11-7-6(8)2-5(4-10)3-9-7/h2-3,10H,4H2,1H3
(3)InChIKey: IRKOZGUDGGFSRE-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C7H8ClNO2/c1-11-7-6(8)2-5(4-10)3-9-7/h2-3,10H,4H2,1H3
(5)Std. InChIKey: IRKOZGUDGGFSRE-UHFFFAOYSA-N