Name: 4-CARBOXYMETHOXY-PIPERIDINE-1-CARBOXYLIC ACID BENZYL ESTER
SKU: 138163-07-2

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Basic Information

Molecular Structure:
CAS No.:	138163-07-2
Name:	4-CARBOXYMETHOXY-PIPERIDINE-1-CARBOXYLIC ACID BENZYL ESTER
Article Data:	13

Formula:	C₁₅H₁₉NO₅
Molecular Weight:	277.32
Synonyms:	Methyl N- Cbz -piperidine-4-carboxylate;Methyl 1-Cbz-Isonipecotate;
Density:	1.27 g/cm³
Boiling Point:	493.8 °C at 760 mmHg
Flash Point:	252.4 °C
PSA:	55.84000
LogP:	2.14610

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Specification

The (1-N-Cbz-piperidin-4-yloxy)acetic acid is an organic compound with the formula C₁₅H₁₉NO₅. The systematic name of this chemical is ({1-[(benzyloxy)carbonyl]piperidin-4-yl}oxy)acetic acid. With the CAS registry number 138163-07-2, it is also named as 4-Carboxymethoxy-piperidine-1-carboxylic acid benzyl ester. The product's category is Pharmacetical.

Physical properties about (1-N-Cbz-piperidin-4-yloxy)acetic acid are: (1)ACD/LogP: 0.98; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 6; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 6; (9)Polar Surface Area: 76.07 Å²; (10)Index of Refraction: 1.57; (11)Molar Refractivity: 75.49 cm³; (12)Molar Volume: 229.9 cm³; (13)Polarizability: 29.92×10^-24cm³; (14)Surface Tension: 55.3 dyne/cm; (15)Density: 1.27 g/cm³; (16)Flash Point: 252.4 °C; (17)Enthalpy of Vaporization: 80.15 kJ/mol; (18)Boiling Point: 493.8 °C at 760 mmHg; (19)Vapour Pressure: 1.44E-10 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCc1ccccc1)N2CCC(OCC(O)=O)CC2
(2)InChI: InChI=1/C15H19NO5/c17-14(18)11-20-13-6-8-16(9-7-13)15(19)21-10-12-4-2-1-3-5-12/h1-5,13H,6-11H2,(H,17,18)
(3)InChIKey: WMFVDLNUEFUSES-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C15H19NO5/c17-14(18)11-20-13-6-8-16(9-7-13)15(19)21-10-12-4-2-1-3-5-12/h1-5,13H,6-11H2,(H,17,18)
(5)Std. InChIKey: WMFVDLNUEFUSES-UHFFFAOYSA-N