1,2-Ethanediol,1-phenyl-, 1,2-dipropanoate supplier

Name
(1-phenyl-2-propanoyloxy-ethyl) propanoate
EINECS
CAS No. 13756-18-8
Article Data2
CAS DataBase
Density 1.092 g/cm³
Solubility
Melting Point
Formula C₁₄H₁₈O₄
Boiling Point 336.2 °C at 760 mmHg
Molecular Weight 250.295
Flash Point 161.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1,2-Ethanediol,1-phenyl-, dipropanoate (9CI);1,2-Ethanediol, 1-phenyl-, dipropionate (8CI);NSC 71619;
PSA 52.60000
LogP 2.63410

1,2-Ethanediol,1-phenyl-, 1,2-dipropanoate Specification

This chemical is called 1,2-Ethanediol,1-phenyl-, 1,2-dipropanoate, and its systematic name is 1-phenylethane-1,2-diyl dipropanoate. With the molecular formula of C₁₄H₁₈O₄, its molecular weight is 250.29. The CAS registry number of this chemical is 13756-18-8.

Other characteristics of the 1,2-Ethanediol,1-phenyl-, 1,2-dipropanoate can be summarised as followings: (1)ACD/LogP: 2.78; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 4; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 8; (6)Polar Surface Area: 52.6 Å²; (7)Index of Refraction: 1.498; (8)Molar Refractivity: 67.15 cm³; (9)Molar Volume: 229 cm³; (10)Polarizability: 26.62×10^-24cm³; (11)Surface Tension: 38.5 dyne/cm; (12)Density: 1.092 g/cm³; (13)Flash Point: 161.2 °C; (14)Enthalpy of Vaporization: 57.94 kJ/mol; (15)Boiling Point: 336.2 °C at 760 mmHg; (16)Vapour Pressure: 0.000114 mmHg at 25°C.

You can still convert the following datas into molecular structure:
1.SMILES: O=C(OCC(OC(=O)CC)c1ccccc1)CC
2.InChI: InChI=1/C14H18O4/c1-3-13(15)17-10-12(18-14(16)4-2)11-8-6-5-7-9-11/h5-9,12H,3-4,10H2,1-2H3
3.InChIKey: XVAFLALVAOXSMJ-UHFFFAOYAP

Product Name

(1-phenyl-2-propanoyloxy-ethyl) propanoate

1,2-Ethanediol,1-phenyl-, 1,2-dipropanoate Specification

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