Name: L-Pipecolic acid hydrochloride
SKU: 2133-33-7

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Basic Information

Molecular Structure:
CAS No.:	2133-33-7
Name:	L-Pipecolic acid hydrochloride
Article Data:	1

Formula:	C₆H₁₂ClNO₂
Molecular Weight:	165.62
Synonyms:	2-Piperidinecarboxylicacid, hydrochloride, (2S)- (9CI);(S)-2-Piperidinecarboxylic acidhydrochloride;L(-)-Pipecolic acid hydrochloride;2-Piperidinecarboxylic acid, hydrochloride,(S)-;Pipecolic acid, hydrochloride, L- (8CI);L-Pipecolic acidhydrochloride;
Boiling Point:	265.8 °C at 760 mmHg
Flash Point:	114.5 °C
PSA:	49.33000
LogP:	1.34390

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Specification

The 2-Piperidinecarboxylicacid, hydrochloride (1:1), (2S)-, with CAS registry number 2133-33-7, has the systematic name of piperidine-2-carboxylic acid hydrochloride (1:1). Besides this, it is also called L-Pipecolic acid hydrochloride. And the chemical formula of this chemical is C₆H₁₂ClNO₂.

Physical properties of 2-Piperidinecarboxylicacid, hydrochloride (1:1), (2S)-: (1)ACD/LogP: 0.00; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.5; (4)ACD/LogD (pH 7.4): -2.5; (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: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 29.54 Å²; (13)Flash Point: 114.5 °C; (14)Enthalpy of Vaporization: 55.45 kJ/mol; (15)Boiling Point: 265.8 °C at 760 mmHg; (16)Vapour Pressure: 0.0026 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(O)C1NCCCC1.Cl
(2)InChI: InChI=1/C6H11NO2.ClH/c8-6(9)5-3-1-2-4-7-5;/h5,7H,1-4H2,(H,8,9);1H
(3)InChIKey: AUGDEGXARBUSFU-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C6H11NO2.ClH/c8-6(9)5-3-1-2-4-7-5;/h5,7H,1-4H2,(H,8,9);1H
(5)Std. InChIKey: AUGDEGXARBUSFU-UHFFFAOYSA-N