CAS No.88046-02-0,2-BROMO-4-(1-PIPERIDINOMETHYL)PYRIDINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	88046-02-0
Name:	2-BROMO-4-(1-PIPERIDINOMETHYL)PYRIDINE

Formula:	C₁₁H₁₅BrN₂
Molecular Weight:	255.15
Synonyms:	2-Bromo-4-[(piperidin-1-yl)methyl]pyridine;
Density:	1.377 g/cm³
Boiling Point:	330.7 °C at 760 mmHg
Flash Point:	153.8 °C
PSA:	16.13000
LogP:	2.76790

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Specification

This chemical is called Pyridine, 2-bromo-4-(1-piperidinylmethyl)-, and it can also be named as 2-Bromo-4-(1-piperidinylmethyl)pyridine. With the molecular formula of C₁₁H₁₅BrN₂, its molecular weight is 255.15. The CAS registry number of this chemical is 88046-02-0.

Other characteristics of the Pyridine, 2-bromo-4-(1-piperidinylmethyl)- can be summarised as followings: (1)ACD/LogP: 2.07; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.08; (4)ACD/LogD (pH 7.4): 1.7; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 9.47; (7)ACD/KOC (pH 5.5): 3.25; (8)ACD/KOC (pH 7.4): 137.05; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 16.13 Å²; (13)Index of Refraction: 1.579; (14)Molar Refractivity: 61.57 cm³; (15)Molar Volume: 185.2 cm³; (16)Polarizability: 24.4×10^-24cm³; (17)Surface Tension: 47.9 dyne/cm; (18)Density: 1.377 g/cm³; (19)Flash Point: 153.8 °C; (20)Enthalpy of Vaporization: 57.33 kJ/mol; (21)Boiling Point: 330.7 °C at 760 mmHg; (22)Vapour Pressure: 0.000164 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: Brc2cc(CN1CCCCC1)ccn2
2.InChI: InChI=1/C11H15BrN2/c12-11-8-10(4-5-13-11)9-14-6-2-1-3-7-14/h4-5,8H,1-3,6-7,9H2
3.InChIKey: ZTUBSWOWTOUXJJ-UHFFFAOYAG