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351184-42-4

Basic Information
CAS No.: 351184-42-4
Name: N-Fmoc-4-piperidinol
Article Data: 4
Molecular Structure:
Molecular Structure of 351184-42-4 (N-Fmoc-4-piperidinol)
Formula: C20H21NO3
Molecular Weight: 323.39
Synonyms: FMOC-4-HYDROXYPIPERIDINE;
Density: 1.26g/cm3
Boiling Point: 510.7 °C at 760 mmHg
Flash Point: 262.7 °C
PSA: 49.77000
LogP: 3.33010
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    N-Fmoc-4-piperidinol

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  • 4-hydroxy-1-piperidinecarboxylic acid 9H-fluoren-9-ylmethyl ester

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  • N-FMOC-4-PIPERIDINOL

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  • 9H-fluoren-9-ylmethyl 4-hydroxypiperidine-1-carboxylate

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Specification

The N-Fmoc-4-piperidinol, with CAS registry number 351184-42-4, belongs to the following product category: pharmacetical. It has the systematic name of 9H-fluoren-9-ylmethyl 4-hydroxypiperidine-1-carboxylate. And the chemical formula of this chemical is C20H21NO3.

Physical properties of N-Fmoc-4-piperidinol: (1)ACD/LogP: 3.05; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.05; (4)ACD/LogD (pH 7.4): 3.05; (5)ACD/BCF (pH 5.5): 123; (6)ACD/BCF (pH 7.4): 123; (7)ACD/KOC (pH 5.5): 1090.37; (8)ACD/KOC (pH 7.4): 1090.37; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 38.77 Å2; (13)Index of Refraction: 1.627; (14)Molar Refractivity: 90.97 cm3; (15)Molar Volume: 256.4 cm3; (16)Polarizability: 36.06×10-24cm3; (17)Surface Tension: 55.5 dyne/cm; (18)Density: 1.26 g/cm3; (19)Flash Point: 262.7 °C; (20)Enthalpy of Vaporization: 82.29 kJ/mol; (21)Boiling Point: 510.7 °C at 760 mmHg; (22)Vapour Pressure: 2.97E-11 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC3c1ccccc1c2ccccc23)N4CCC(O)CC4
(2)InChI: InChI=1/C20H21NO3/c22-14-9-11-21(12-10-14)20(23)24-13-19-17-7-3-1-5-15(17)16-6-2-4-8-18(16)19/h1-8,14,19,22H,9-13H2
(3)InChIKey: DANUFRHHXWZNIK-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C20H21NO3/c22-14-9-11-21(12-10-14)20(23)24-13-19-17-7-3-1-5-15(17)16-6-2-4-8-18(16)19/h1-8,14,19,22H,9-13H2
(5)Std. InChIKey: DANUFRHHXWZNIK-UHFFFAOYSA-N