Methyl piperidine-3-carboxylate hydrochloride supplier

Name
METHYL PIPERIDINE-3-CARBOXYLATE HYDROCHLORIDE
EINECS 203-126-8
CAS No. 89895-55-6
Article Data4
CAS DataBase
Density
Solubility
Melting Point
Formula C₇H₁₃NO₂^.HCl
Boiling Point 235.3 °C at 760 mmHg
Molecular Weight 179.647
Flash Point 96.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-Piperidinecarboxylicacid, methyl ester, hydrochloride (9CI);Nipecotic acid, methyl ester,hydrochloride (7CI);Methyl 3-piperidinecarboxylate hydrochloride;Methylnipecotate hydrochloride;
PSA 38.33000
LogP 1.28980

Methyl piperidine-3-carboxylate hydrochloride Specification

The Methyl piperidine-3-carboxylate hydrochloride, with the CAS registry number 89895-55-6, is also known as 3-Piperidinecarboxylic acid, methyl ester, hydrochloride (1:1). This chemical's molecular formula is C₇H₁₃NO₂^.HCl and molecular weight is 179.64. Its systematic name is called methyl piperidine-3-carboxylate hydrochloride (1:1).

Physical properties of Methyl piperidine-3-carboxylate hydrochloride: (1)ACD/LogP: 0.43; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 2; (10)Flash Point: 96.1 °C; (11)Enthalpy of Vaporization: 48.16 kJ/mol; (12)Boiling Point: 235.3 °C at 760 mmHg; (13)Vapour Pressure: 0.0408 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cl.O=C(OC)C1CNCCC1
(2)InChI: InChI=1/C7H13NO2.ClH/c1-10-7(9)6-3-2-4-8-5-6;/h6,8H,2-5H2,1H3;1H
(3)InChIKey: BQQZKNAQDKIGGZ-UHFFFAOYAY

Product Name

METHYL PIPERIDINE-3-CARBOXYLATE HYDROCHLORIDE

Methyl piperidine-3-carboxylate hydrochloride Specification

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