Benzeneaceticacid, a-(1-methylpropyl)-, 2-(diethylamino)ethyl ester supplier

Name
2-(diethylamino)ethyl 3-methyl-2-phenylpentanoate
EINECS
CAS No. 26878-41-1
Density 0.974 g/cm³
Solubility
Melting Point
Formula C₁₈H₂₉NO₂
Boiling Point 374 °C at 760 mmHg
Molecular Weight 291.434
Flash Point 110.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Valericacid, 3-methyl-2-phenyl-, 2-(diethylamino)ethyl ester (6CI,7CI,8CI);NSC 165857;
PSA
LogP

Benzeneaceticacid, a-(1-methylpropyl)-, 2-(diethylamino)ethyl ester Specification

The CAS register number of Benzeneaceticacid, a-(1-methylpropyl)-, 2-(diethylamino)ethyl ester is 26878-41-1. The IUPAC name about this chemical is 2-(diethylamino)ethyl 3-methyl-2-phenylpentanoate. The molecular formula about this chemical is C₁₈H₂₉NO₂ and the molecular weight is 291.43376.

Physical properties about Benzeneaceticacid, a-(1-methylpropyl)-, 2-(diethylamino)ethyl ester are: (1)ACD/LogP: 4.94; (2)#H bond acceptors: 3; (3)#Freely Rotating Bonds: 10; (4)Polar Surface Area: 29.54 Å²; (5)Index of Refraction: 1.497; (6)Molar Refractivity: 87.58 cm³; (7)Molar Volume: 299.1 cm³; (8)Polarizability: 34.72x10^-24cm³; (9)Surface Tension: 35 dyne/cm; (10)Density: 0.974 g/cm³; (11)Flash Point: 110.9 °C; (12)Enthalpy of Vaporization: 62.13 kJ/mol; (13)Boiling Point: 374 °C at 760 mmHg; (14)Vapour Pressure: 8.62E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCCN(CC)CC)C(c1ccccc1)C(CC)C
(2)InChI: InChI=1/C18H29NO2/c1-5-15(4)17(16-11-9-8-10-12-16)18(20)21-14-13-19(6-2)7-3/h8-12,15,17H,5-7,13-14H2,1-4H3
(3)InChIKey: LKQUJKDIEHGPLY-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C18H29NO2/c1-5-15(4)17(16-11-9-8-10-12-16)18(20)21-14-13-19(6-2)7-3/h8-12,15,17H,5-7,13-14H2,1-4H3
(5)Std. InChIKey: LKQUJKDIEHGPLY-UHFFFAOYSA-N

Product Name

2-(diethylamino)ethyl 3-methyl-2-phenylpentanoate

Benzeneaceticacid, a-(1-methylpropyl)-, 2-(diethylamino)ethyl ester Specification

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