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(2S)-2-Piperidinecarboxylic acid hydrochloride

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Name

(2S)-2-Piperidinecarboxylic acid hydrochloride

EINECS N/A
CAS No. 2133-33-7 Density N/A
PSA 49.33000 LogP 1.34390
Solubility N/A Melting Point N/A
Formula C6H12ClNO2 Boiling Point 265.8 °C at 760 mmHg
Molecular Weight 165.62 Flash Point 114.5 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 2133-33-7 (L-Pipecolic acid hydrochloride) Hazard Symbols N/A
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;

Article Data 1

(2S)-2-Piperidinecarboxylic acid hydrochloride 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

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