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CAS No.: | 3466-80-6 |
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Name: | 2-PHENYLPIPERIDINE |
Article Data: | 88 |
Molecular Structure: | |
Formula: | C11H15N |
Molecular Weight: | 161.247 |
Synonyms: | (Piperidin-2-yl)benzene; |
EINECS: | 222-422-6 |
Density: | 0.967 g/cm3 |
Melting Point: | 18 °C |
Boiling Point: | 257.253 °C at 760 mmHg |
Flash Point: | 110.96 °C |
Appearance: | clear colorless liquid |
Hazard Symbols: | Xi |
Risk Codes: | 20/21/22 |
Safety: | 23-24/25 |
PSA: | 12.03000 |
LogP: | 2.83000 |
The Piperidine, 2-phenyl-, with the CAS registry number of 3466-80-6, is also known as 2-Phenyl-piperidine. It belongs to the product category of Piperidine. Its EINECS registry number is 222-422-6. This chemical's molecular formula is C11H15N and molecular weight is 161.24. What's more, its IUPAC name is 2-Phenylpiperidine.
Physical properties about Piperidine, 2-phenyl- are: (1)ACD/LogP: 2.34; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.75; (4)ACD/LogD (pH 7.4): -0.45; (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: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 3.24 Å2; (13)Index of Refraction: 1.522; (14)Molar Refractivity: 50.85 cm3; (15)Molar Volume: 166.6 cm3; (16)Polarizability: 20.15×10-24 cm3; (17)Surface Tension: 35.3 dyne/cm; (18)Density: 0.967 g/cm3; (19)Flash Point: 111 °C; (20)Enthalpy of Vaporization: 49.48 kJ/mol; (21)Boiling Point: 257.3 °C at 760 mmHg; (22)Vapour Pressure: 0.0147 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: c1cc(ccc1)C2NCCCC2
(2) InChI: InChI=1/C11H15N/c1-2-6-10(7-3-1)11-8-4-5-9-12-11/h1-3,6-7,11-12H,4-5,8-9H2
(3) InChIKey: WGIAUTGOUJDVEI-UHFFFAOYAB