1-Pyridin-2-ylmethylpiperidin-4-one supplier

Name
1-Pyridin-2-ylmethylpiperidin-4-one
EINECS
CAS No. 41661-56-7
Article Data5
CAS DataBase
Density 1.149 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₄N₂O
Boiling Point 318.1 °C at 760 mmHg
Molecular Weight 190.245
Flash Point 146.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1-Pyridin-2-ylmethylpiperidin-4-one;
PSA 33.20000
LogP 1.18440

1-Pyridin-2-ylmethylpiperidin-4-one Specification

The 1-Pyridin-2-ylmethylpiperidin-4-one with the CAS number 41661-56-7 is also called 4-Piperidinone,1-(2-pyridinylmethyl)-. Its molecular formula is C₁₁H₁₄N₂O. The product category is API intermediates. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 1-Pyridin-2-ylmethylpiperidin-4-one are: (1)ACD/LogP: -0.30; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.97; (4)ACD/LogD (pH 7.4): -0.32; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 3.48; (8)ACD/KOC (pH 7.4): 15.55; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 33.2 Å²; (13)Index of Refraction: 1.566; (14)Molar Refractivity: 54.01 cm³; (15)Molar Volume: 165.5 cm³; (16)Polarizability: 21.41×10^-24cm³; (17)Surface Tension: 50.6 dyne/cm; (18)Enthalpy of Vaporization: 55.96 kJ/mol; (19)Vapour Pressure: 0.000368 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C2CCN(Cc1ncccc1)CC2
(2)InChI: InChI=1/C11H14N2O/c14-11-4-7-13(8-5-11)9-10-3-1-2-6-12-10/h1-3,6H,4-5,7-9H2
(3)InChIKey: LQHWXULWFQQUDQ-UHFFFAOYAF

Product Name

1-Pyridin-2-ylmethylpiperidin-4-one

1-Pyridin-2-ylmethylpiperidin-4-one Specification

Related Products

Hot Products