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4-Piperazin-1-ylmethyl-benzoic acid methyl ester

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Name

4-Piperazin-1-ylmethyl-benzoic acid methyl ester

EINECS N/A
CAS No. 86620-81-7 Density 1.117 g/cm3
PSA 41.57000 LogP 1.14510
Solubility N/A Melting Point N/A
Formula C13H18 N2 O2 Boiling Point 355.6 ºCat 760 mmHg
Molecular Weight 234.298 Flash Point 168.9 ºC
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 86620-81-7 (4-PIPERAZIN-1-YLMETHYL-BENZOIC ACID METHYL ESTER) Hazard Symbols N/A
Synonyms

methyl 4-(piperazin-1-ylmethyl)benzoate;

Article Data 10

4-Piperazin-1-ylmethyl-benzoic acid methyl ester Chemical Properties

Empirical Formula: C13H18N2O2
Molecular Weight: 234.2942g/mol
Structure of 4-Piperazin-1-ylmethyl-benzoic acid methyl ester (CAS NO.86620-81-7):

Index of Refraction: 1.544
Molar Refractivity: 66.3 cm3
Molar Volume: 209.7 cm3
Polarizability: 26.28×10-24cm3
Surface Tension: 41.6 dyne/cm
Density: 1.117 g/cm3
Flash Point: 168.9 °C
Enthalpy of Vaporization: 60.08 kJ/mol
Boiling Point: 355.6 °C at 760 mmHg
Vapour Pressure: 3.08E-05 mmHg at 25°C 
Product Categories: API intermediates 
Systematic Name: methyl 4-(piperazin-1-ylmethyl)benzoate
SMILES: O=C(OC)c1ccc(cc1)CN2CCNCC2
InChI: InChI=1/C13H18N2O2/c1-17-13(16)12-4-2-11(3-5-12)10-15-8-6-14-7-9-15/h2-5,14H,6-10H2,1H3
InChIKey: XJIVYTXCTMWGLR-UHFFFAOYAV

4-Piperazin-1-ylmethyl-benzoic acid methyl ester Specification

 4-Piperazin-1-ylmethyl-benzoic acid methyl ester , its cas register number is 86620-81-7. It also can be called Benzoic acid, 4-(1-piperazinylmethyl)-, methyl ester ; Methyl 4-(piperazin-1-ylmethyl)benzoate ; 4-(1-Piperaziyl methyl) benzoic acid methyl ester .

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