CAS No.5764-85-2,Ethyl-3-Hydroxy-3-Phenyl Propionate Suppliers

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Basic Information

Molecular Structure:
CAS No.:	5764-85-2
Name:	Ethyl-3-Hydroxy-3-Phenyl Propionate
Article Data:	175

Formula:	C₁₁H₁₄O₃
Molecular Weight:	194.23
Synonyms:	Hydracrylicacid, 3-phenyl-, ethyl ester (6CI,7CI,8CI);3-Hydroxy-3-phenylpropionic acid ethyl ester;Ethyl3-hydroxy-3-phenylpropanoate;Ethyl 3-hydroxy-3-phenylpropionate;Ethyl3-phenyl-3-hydroxypropionate;Ethyl 3-phenylhydracrylate;NSC 226071;b-Hydroxybenzenepropanoic acidethyl ester;
EINECS:	227-288-2
Density:	1.119 g/cm³
Boiling Point:	315.3 °C at 760 mmHg
Flash Point:	132.6 °C
PSA:	46.53000
LogP:	1.67320

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Specification

The CAS register number of Benzenepropanoic acid, beta-hydroxy-, ethyl ester is 5764-85-2. It also can be called as 3-Hydroxy-3-phenylpropionic acid ethyl ester and the IUPAC name about this chemical is ethyl 3-hydroxy-3-phenylpropanoate. The molecular formula about this chemical is C₁₁H₁₄O₃ and the molecular weight is 194.23.

Physical properties about Benzenepropanoic acid, beta-hydroxy-, ethyl ester are: (1)ACD/LogP: 1.36; (2)ACD/LogD (pH 5.5): 1.36; (3)ACD/LogD (pH 7.4): 1.36; (4)ACD/BCF (pH 5.5): 6.38; (5)ACD/BCF (pH 7.4): 6.38; (6)ACD/KOC (pH 5.5): 131.09; (7)ACD/KOC (pH 7.4): 131.09; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 6; (11)Polar Surface Area: 35.53Å²; (12)Index of Refraction: 1.523; (13)Molar Refractivity: 53.01 cm³; (14)Molar Volume: 173.5 cm³; (15)Polarizability: 21.01x10^-24cm³; (16)Surface Tension: 42.6 dyne/cm; (17)Enthalpy of Vaporization: 58.76 kJ/mol; (18)Boiling Point: 315.3 °C at 760 mmHg; (19)Vapour Pressure: 0.000186 mmHg at 25°C.

Preparation: this chemical can be prepared by 2-diazo-3-hydroxy-3-phenyl-propionic acid ethyl ester. This reaction will need reagent H₂, catalyst Pd-C and solvent ethanol.

Uses of Benzenepropanoic acid, beta-hydroxy-, ethyl ester: it can be used to produce 3t-phenyl-acrylic acid ethyl ester at temperature of 200 °C. This reaction will need reagent NaOH and ethanol.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC)CC(O)c1ccccc1
(2)InChI: InChI=1/C11H14O3/c1-2-14-11(13)8-10(12)9-6-4-3-5-7-9/h3-7,10,12H,2,8H2,1H3
(3)InChIKey: DVIBDQWVFHDBOP-UHFFFAOYAJ
(4)Std. InChI: InChI=1S/C11H14O3/c1-2-14-11(13)8-10(12)9-6-4-3-5-7-9/h3-7,10,12H,2,8H2,1H3
(5)Std. InChIKey: DVIBDQWVFHDBOP-UHFFFAOYSA-N