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58258-01-8

Basic Information
CAS No.: 58258-01-8
Name: 4-(DIPHENYLMETHOXY)PIPERIDINE
Article Data: 16
Molecular Structure:
Molecular Structure of 58258-01-8 (4-(DIPHENYLMETHOXY)PIPERIDINE)
Formula: C18H21NO
Molecular Weight: 267.371
Synonyms: 4-(4-Benzhydryloxy)piperidine;4-(Benzhydryloxy)piperidine;4-(Diphenylmethoxy)piperidine;
Density: 1.09 g/cm3
Melting Point: 202-204℃
Boiling Point: 383.5 °C at 760 mmHg
Flash Point: 162.9 °C
Appearance: low melting light-brown solid
PSA: 21.26000
LogP: 3.87340
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  • 4-(DIPHENYLMETHOXY)PIPERIDINE CAS No.58258-01-8

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Specification

The Piperidine, 4-(diphenylmethoxy)-, with the CAS registry number of 58258-01-8, is also known as 4-Diphenylmethoxypiperidinehydrochloride. It belongs to the product categories of Piperidine; Intermediates & Fine Chemicals; Metabolites & Impurities; Pharmaceuticals. This chemical's molecular formula is C18H21NO and molecular weight is 267.37. What's more, its systematic name is called 4-(Diphenylmethoxy)piperidine. Besides, it is a metabolite of Ebastine.

Physical properties about Piperidine, 4-(diphenylmethoxy)- are: (1)ACD/LogP: 4.15; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.06; (4)ACD/LogD (pH 7.4): 1.52; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1.95; (7)ACD/KOC (pH 5.5): 3.51; (8)ACD/KOC (pH 7.4): 9.99; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 12.47 Å2; (13)Index of Refraction: 1.589; (14)Molar Refractivity: 82.55 cm3; (15)Molar Volume: 244.9 cm3; (16)Surface Tension: 44.6 dyne/cm; (17)Density: 1.09 g/cm3; (18)Flash Point: 162.9 °C; (19)Enthalpy of Vaporization: 63.21 kJ/mol; (20)Boiling Point: 383.5 °C at 760 mmHg; (21)Vapour Pressure: 4.38E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O(C(c1ccccc1)c2ccccc2)C3CCNCC3
(2) InChI: InChI=1/C18H21NO/c1-3-7-15(8-4-1)18(16-9-5-2-6-10-16)20-17-11-13-19-14-12-17/h1-10,17-19H,11-14H2
(3) InChIKey: OQAOREVBRZVXDS-UHFFFAOYAP