Propyl phenylacetate supplier

Name
FEMA 2955
EINECS 225-012-5
CAS No. 4606-15-9
Article Data26
CAS DataBase
Density 1.016 g/cm³
Solubility
Melting Point
Formula C₁₁H₁₄O₂
Boiling Point 243.9 °C at 760 mmHg
Molecular Weight 178.231
Flash Point 101.8 °C
Transport Information
Appearance COLORLESS LIQUID
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Aceticacid, phenyl-, propyl ester (6CI,7CI,8CI);NSC 6579;Propyl phenylacetate;
PSA 26.30000
LogP 2.18230

Propyl phenylacetate Specification

This chemical is called Propyl phenylacetate, and it can also be named as benzeneacetic acid, propyl ester. With the molecular formula of C₁₁H₁₄O₂, its molecular weight is 178.23. The CAS registry number of this chemical is 4606-15-9.

Other characteristics of the Propyl phenylacetate can be summarised as followings: (1)ACD/LogP: 3.03; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 26.3 Å²; (7)Index of Refraction: 1.499; (8)Molar Refractivity: 51.47 cm³; (9)Molar Volume: 175.2 cm³; (10)Polarizability: 20.4×10^-24cm³; (11)Surface Tension: 35.5 dyne/cm; (12)Density: 1.016 g/cm³; (13)Flash Point: 101.8 °C; (14)Enthalpy of Vaporization: 48.1 kJ/mol; (15)Boiling Point: 243.9 °C at 760 mmHg; (16)Vapour Pressure: 0.0312 mmHg at 25°C.

Production method of this chemical: The Propyl phenylacetate could be obtained by the reactants of propan-1-ol and phenylacetic acid. This reaction needs the reagent of zeolite RE H-Y. The yield is 89 %. In addition, this reaction should be taken for 8 hours at the temperature of 150 °C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(OCCC)Cc1ccccc1
2.InChI: InChI=1/C11H14O2/c1-2-8-13-11(12)9-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3
3.InChIKey:GXXFZZLGPFNITM-UHFFFAOYAB

Product Name

FEMA 2955

Propyl phenylacetate Specification

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