-
Name
1-METHYL-PIPERIDINE-3-CARBOXYLIC ACID METHYL ESTER
- EINECS
- CAS No. 1690-72-8
- Article Data19
- CAS DataBase
- Density 1.013 g/cm3
- Solubility
- Melting Point
- Formula C8H15NO2
- Boiling Point 190 °C at 760 mmHg
- Molecular Weight 157.213
- Flash Point 68 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms Nipecoticacid, 1-methyl-, methyl ester (6CI,7CI,8CI);1-Methylnipecotinic acid methylester;Dihydroarecaidine, methyl ester;Dihydroarecoline;Methyl N-methylnipecotate;
- PSA 29.54000
- LogP 0.43910
Methyl 1-methylpiperidine-3-carboxylate Chemical Properties
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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
Methyl 1-methylpiperidine-3-carboxylate 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. |
Methyl 1-methylpiperidine-3-carboxylate 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 .
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