1-Benzyl-3, 3-dimethylpiperidin-4-one supplier

Name
1-BENZYL-3,3-DIMETHYL-PIPERIDIN-4-ONE
EINECS
CAS No. 173186-91-9
Article Data18
CAS DataBase
Density 1.031 g/cm³
Solubility
Melting Point
Formula C₁₄H₁₉NO
Boiling Point 317.995 °C at 760 mmHg
Molecular Weight 217.311
Flash Point 136.723 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms N-Benzyl-3, 3-dimethyl-4-piperidone;
PSA 20.31000
LogP 2.42550

1-Benzyl-3, 3-dimethylpiperidin-4-one Specification

The 1-Benzyl-3, 3-dimethylpiperidin-4-one, with the CAS registry number 173186-91-9, is also known as N-Benzyl-3, 3-dimethyl-4-piperidone. This chemical's molecular formula is C₁₄H₁₉NO and molecular weight is 217.3068. What's more, its IUPAC name is 1-Benzyl-3, 3-dimethylpiperidin-4-one.

Physical properties about 1-Benzyl-3, 3-dimethylpiperidin-4-one are: (1)ACD/LogP: 2.90; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 20.31 Å²; (7)Index of Refraction: 1.531; (8)Molar Refractivity: 65.244 cm³; (9)Molar Volume: 210.73 cm³; (10)Polarizability: 25.865×10^-24 cm³; (11)Surface Tension: 37.781 dyne/cm; (12)Density: 1.031 g/cm³; (13)Flash Point: 136.723 °C; (14)Enthalpy of Vaporization: 55.946 kJ/mol; (15)Boiling Point: 317.995 °C at 760 mmHg; (16)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C2CCN(Cc1ccccc1)CC2(C)C
(2) InChI: InChI=1/C14H19NO/c1-14(2)11-15(9-8-13(14)16)10-12-6-4-3-5-7-12/h3-7H,8-11H2,1-2H3
(3) InChIKey: YKQMBPQMCWGNDY-UHFFFAOYAR

Product Name

1-BENZYL-3,3-DIMETHYL-PIPERIDIN-4-ONE

1-Benzyl-3, 3-dimethylpiperidin-4-one Specification

Related Products

Hot Products