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Basic Information
CAS No.: 5166-67-6
Name: Ethyl 1-methylnipecotate
Article Data: 15
Molecular Structure:
Molecular Structure of 5166-67-6 (Ethyl 1-methylnipecotate)
Formula: C9H17NO2
Molecular Weight: 171.239
Synonyms: Nipecoticacid, 1-methyl-, ethyl ester (6CI,7CI,8CI);Ethyl1-methyl-3-piperidinecarboxylate;EthylN-methylnipecotate;NSC 64739;3-Piperidinecarboxylicacid, 1-methyl-, ethyl ester;
EINECS: 225-951-0
Density: 0.997 g/cm3
Boiling Point: 211.1 °C at 760 mmHg
Flash Point: 68.3 °C
Appearance: Clear colorless to pale yellow liquid
Hazard Symbols: IrritantXi
Risk Codes: 36/37/38   
Safety: 26-36/37/39-37/39
PSA: 29.54000
LogP: 0.82920
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Chemistry


IUPAC Name: Ethyl 1-methylpiperidine-3-carboxylate
Canonical SMILES: CCOC(=O)C1CCCN(C1)C
InChI: InChI=1S/C9H17NO2/c1-3-12-9(11)8-5-4-6-10(2)7-8/h8H,3-7H2,1-2H3
InChIKey: VFJJNMLPRDRTCO-UHFFFAOYSA-N
Molecular Weight: 171.23678 [g/mol]
Molecular Formula: C9H17NO2
XLogP3-AA: 1
H-Bond Donor: 0
H-Bond Acceptor: 3 
EINECS: 225-951-0 
Index of Refraction: 1.458
Molar Refractivity: 46.91 cm3
Molar Volume: 171.6 cm3
Surface Tension: 32.7 dyne/cm
Density: 0.997 g/cm3
Flash Point: 68.3 °C
Enthalpy of Vaporization: 44.74 kJ/mol
Boiling Point: 211.1 °C at 760 mmHg
Vapour Pressure: 0.186 mmHg at 25 °C
Appearance: Clear colorless to pale yellow liquid
Product Categories of Ethyl 1-methylnipecotate (CAS NO.5166-67-6): Heterocyclic Compounds

Safety Profile

Hazard Codes: IrritantXi
Risk Statements: 36/37/38 
R36/37/38:Irritating to eyes, respiratory system and skin.
Safety Statements: 26-36/37/39-37/39 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection. 
S37/39:Wear suitable gloves and eye/face protection.
WGK Germany: 3
Hazard Note of Ethyl 1-methylnipecotate (CAS NO.5166-67-6): Irritant

Specification

 Ethyl 1-methylnipecotate (CAS NO.5166-67-6), its Synonyms are Ethyl 1-methylpiperidine-3-carboxylate ; Nipecoticacid, 1-methyl-, ethyl ester (6CI,7CI,8CI) ; EthylN-methylnipecotate ; 3-Piperidinecarboxylicacid, 1-methyl-, ethyl ester .