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Basic Information
CAS No.: 1690-72-8
Name: 1-METHYL-PIPERIDINE-3-CARBOXYLIC ACID METHYL ESTER
Article Data: 19
Molecular Structure:
Molecular Structure of 1690-72-8 (1-METHYL-PIPERIDINE-3-CARBOXYLIC ACID METHYL ESTER)
Formula: C8H15NO2
Molecular Weight: 157.213
Synonyms: Nipecoticacid, 1-methyl-, methyl ester (6CI,7CI,8CI);1-Methylnipecotinic acid methylester;Dihydroarecaidine, methyl ester;Dihydroarecoline;Methyl N-methylnipecotate;
Density: 1.013 g/cm3
Boiling Point: 190 °C at 760 mmHg
Flash Point: 68 °C
PSA: 29.54000
LogP: 0.43910
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Chemistry


IUPAC Name: methyl 1-Methylpiperidine-3-carboxylate
Canonical SMILES: CN1CCCC(C1)C(=O)OC
InChI: InChI=1S/C8H15NO2/c1-9-5-3-4-7(6-9)8(10)11-2/h7H,3-6H2,1-2H3
InChIKey: LLEOWWWENNCINW-UHFFFAOYSA-N
Molecular Weight: 157.2102 [g/mol]
Molecular Formula: C8H15NO2
XLogP3-AA: 0.6
H-Bond Donor: 0
H-Bond Acceptor: 3 
Index of Refraction: 1.457
Molar Refractivity: 42.28 cm3
Molar Volume: 155.1 cm3
Surface Tension: 32.5 dyne/cm
Density: 1.013 g/cm3
Flash Point: 68 °C
Enthalpy of Vaporization: 42.62 kJ/mol
Boiling Point: 190 °C at 760 mmHg
Vapour Pressure: 0.553 mmHg at 25 °C
Product Categories: Heterocyclic Compounds
Classification Code of 3-Piperidinecarboxylicacid, 1-methyl-, methyl ester (CAS NO.1690-72-8): Drug / Therapeutic Agent

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 2gm/kg (2000mg/kg) AUTONOMIC NERVOUS SYSTEM: OTHER (DIRECT) PARASYMPATHOMIMETIC

BEHAVIORAL: TREMOR

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS		 Pharmaceutical Chemistry Journal Vol. 17, Pg. 127, 1983.

Specification

 3-Piperidinecarboxylicacid, 1-methyl-, methyl ester (CAS NO.1690-72-8), its Synonyms are 1-Methylnipecotic acid methyl ester ; Dihydroarecoline ; Methyl N-methylnipecotate ; N-Methyl-3-carbomethoxypiperidine ; Nipecotic acid, 1-methyl-, methyl ester .