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2-(Hydroxy-phenyl-methyl)-acrylic acid methyl ester

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Name

2-(Hydroxy-phenyl-methyl)-acrylic acid methyl ester

EINECS N/A
CAS No. 18020-59-2 Density 1.141 g/cm3
PSA 46.53000 LogP 1.44920
Solubility N/A Melting Point 126-128 °C
Formula C11H12O3 Boiling Point 322.186 °C at 760 mmHg
Molecular Weight 192.214 Flash Point 137.567 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 18020-59-2 (2-(HYDROXY-PHENYL-METHYL)-ACRYLIC ACID METHYL ESTER) Hazard Symbols N/A
Synonyms

Hydracrylicacid, 2-methylene-3-phenyl-, methyl ester (8CI);Methyl 2-methylene-3-phenylhydracrylate;Methyl 3-hydroxy-2-methylene-3-phenylpropanoate;Methyl α-(α-hydroxybenzyl)acrylate;β-Hydroxy-α-methylenebenzenepropanoicacid methyl ester;

Article Data 142

2-(Hydroxy-phenyl-methyl)-acrylic acid methyl ester Specification

The Benzenepropanoic acid, β-hydroxy-α-methylene-, methyl ester, with the CAS registry number 18020-59-2, is also known as Methyl 2-methylene-3-phenylhydracrylate. This chemical's molecular formula is C11H12O3 and molecular weight is 192.21. What's more, its systematic name is methyl 2-[hydroxy(phenyl)methyl]prop-2-enoate.

Physical properties of Benzenepropanoic acid, β-hydroxy-α-methylene-, methyl ester are: (1)ACD/LogP: 1.64; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 37; (6)ACD/BCF (pH 7.4): 37; (7)ACD/KOC (pH 5.5): 461; (8)ACD/KOC (pH 7.4): 461; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 5; (12)olar Surface Area: 46.53 Å2; (13)Index of Refraction: 1.537; (14)Molar Refractivity: 52.581 cm3; (15)Molar Volume: 168.402 cm3; (16)Polarizability: 20.845×10-24cm3; (17)Surface Tension: 41.933 dyne/cm; (18)Density: 1.141 g/cm3; (19)Flash Point: 137.567 °C; (20)Enthalpy of Vaporization: 59.542 kJ/mol; (21)Boiling Point: 322.186 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC)/C(=C)C(O)c1ccccc1
(2)Std. InChI: InChI=1S/C11H12O3/c1-8(11(13)14-2)10(12)9-6-4-3-5-7-9/h3-7,10,12H,1H2,2H3
(3)Std. InChIKey: VZGOKIHNKHAORQ-UHFFFAOYSA-N

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