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Name |
Pyridine,2-(bromomethyl)-6-(1-pyrrolidinyl)- |
EINECS | N/A |
CAS No. | 869901-04-2 | Density | 1.446g/cm3 |
PSA | 16.13000 | LogP | 2.64170 |
Solubility | N/A | Melting Point |
69 °C |
Formula | C10H13BrN2 | Boiling Point | 347.2 °C at 760 mmHg |
Molecular Weight | 241.131 | Flash Point | 163.8 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | C | |
Synonyms |
2-(bromomethyl)-6-pyrrolidin-1-ylpyridine;2-(Bromomethyl)-6-pyrrolidin-1-ylpyridine 97%;1-[6-(Bromomethyl)pyridin-2-yl]pyrrolidine |
Article Data | 2 |
The Pyridine,2-(bromomethyl)-6-(1-pyrrolidinyl)-, with CAS registry number 869901-04-2, has the systematic name of 2-(bromomethyl)-6-pyrrolidin-1-yl-pyridine. Its molecular weight is 241.12762. And the chemical formula of this chemical is C10H13BrN2.
Physical properties of Pyridine,2-(bromomethyl)-6-(1-pyrrolidinyl)-: (1)ACD/LogP: 2.20; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.99; (4)ACD/LogD (pH 7.4): 2.2; (5)#H bond acceptors: 2; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 2; (8)Polar Surface Area: 16.13 Å2; (9)Index of Refraction: 1.602; (10)Molar Refractivity: 57.19 cm3; (11)Molar Volume: 166.6 cm3; (12)Polarizability: 22.67×10-24cm3; (13)Surface Tension: 51.9 dyne/cm; (14)Density: 1.446 g/cm3; (15)Flash Point: 163.8 °C; (16)Enthalpy of Vaporization: 59.14 kJ/mol; (17)Boiling Point: 347.2 °C at 760 mmHg; (18)Vapour Pressure: 5.47E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(nc(c1)N2CCCC2)CBr
(2)InChI: InChI=1/C10H13BrN2/c11-8-9-4-3-5-10(12-9)13-6-1-2-7-13/h3-5H,1-2,6-8H2
(3)InChIKey: UFXKRINLXMWRES-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C10H13BrN2/c11-8-9-4-3-5-10(12-9)13-6-1-2-7-13/h3-5H,1-2,6-8H2
(5)Std. InChIKey: UFXKRINLXMWRES-UHFFFAOYSA-N