Benzeneacetic acid, a-methyl-, ethyl ester, (aR)- supplier

Name
(S)-2-PHENYLPROPIONATE ETHYL
EINECS
CAS No. 111170-56-0
Article Data26
CAS DataBase
Density 1.012 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₄O₂
Boiling Point 232.2 °C at 760 mmHg
Molecular Weight 178.231
Flash Point 93.6 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzeneaceticacid, a-methyl-, ethyl ester, (R)-;(aR)-a-Methylbenzeneacetic acid ethyl ester;Ethyl(R)-2-phenylpropanoate;
PSA 26.30000
LogP 2.35320

Benzeneacetic acid, a-methyl-, ethyl ester, (aR)- Specification

The Benzeneacetic acid, a-methyl-, ethyl ester, (aR)-, also known as (S)-2-Phenylpropionate ethyl, is an organic compound with the formula C₁₁H₁₄O₂. It belongs to the product categories of Chiral Compounds; Esters. With the CAS registry number 111170-56-0, its systematic name is ethyl (2S)-2-phenylpropanoate.

Physical properties of Benzeneacetic acid, a-methyl-, ethyl ester, (aR)-: (1)ACD/LogP: 2.85; (2)#H bond acceptors: 2; (3)#Freely Rotating Bonds: 4; (4)Index of Refraction: 1.496; (5)Molar Refractivity: 51.47 cm³; (6)Molar Volume: 176 cm³; (7)Surface Tension: 34.5 dyne/cm; (8)Density: 1.012 g/cm³; (9)Flash Point: 93.6 °C; (10)Enthalpy of Vaporization: 46.89 kJ/mol; (11)Boiling Point: 232.2 °C at 760 mmHg; (12)Vapour Pressure: 0.0597 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC)[C@H](c1ccccc1)C
(2)InChI: InChI=1/C11H14O2/c1-3-13-11(12)9(2)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3/t9-/m0/s1
(3)InChIKey: UTUVIKZNQWNGIM-VIFPVBQEBE

Product Name

(S)-2-PHENYLPROPIONATE ETHYL

Benzeneacetic acid, a-methyl-, ethyl ester, (aR)- Specification

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