1,4'-Bipiperidine,3-methyl- supplier

Name
4-(3-METHYL-PIPERIDIN-1-YL)-PIPERIDINE
EINECS
CAS No. 551923-14-9
Article Data2
CAS DataBase
Density 0.941g/cm³
Solubility
Melting Point
Formula C₁₁H₂₂N₂
Boiling Point 252.4 °C at 760 mmHg
Molecular Weight 182.309
Flash Point 89.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols Xi
Synonyms 3-Methyl-1,4'-bipiperidine;
PSA 15.27000
LogP 1.73700

1,4'-Bipiperidine,3-methyl- Specification

The 1,4'-Bipiperidine,3-methyl-, with CAS registry number 551923-14-9, belongs to the following product category: Piperidine. It has the systematic name of 3-methyl-1,4'-bipiperidine. Besides this, it is also called 4-(3-Methyl-piperidin-1-yl)-piperidine. And the chemical formula of this chemical is C₁₁H₂₂N₂.

Physical properties of 1,4'-Bipiperidine,3-methyl-: (1)ACD/LogP: 2.02; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.08; (4)ACD/LogD (pH 7.4): -1.71; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 6.48 Å²; (13)Index of Refraction: 1.487; (14)Molar Refractivity: 55.78 cm³; (15)Molar Volume: 193.6 cm³; (16)Polarizability: 22.11×10^-24cm³; (17)Surface Tension: 32.4 dyne/cm; (18)Density: 0.941 g/cm³; (19)Flash Point: 89.9 °C; (20)Enthalpy of Vaporization: 48.97 kJ/mol; (21)Boiling Point: 252.4 °C at 760 mmHg; (22)Vapour Pressure: 0.0194 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: N2CCC(N1CCCC(C1)C)CC2
(2)InChI: InChI=1/C11H22N2/c1-10-3-2-8-13(9-10)11-4-6-12-7-5-11/h10-12H,2-9H2,1H3
(3)InChIKey: HOMQMBUOTAUPAK-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C11H22N2/c1-10-3-2-8-13(9-10)11-4-6-12-7-5-11/h10-12H,2-9H2,1H3
(5)Std. InChIKey: HOMQMBUOTAUPAK-UHFFFAOYSA-N

Product Name

4-(3-METHYL-PIPERIDIN-1-YL)-PIPERIDINE

1,4'-Bipiperidine,3-methyl- Specification

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