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2-Propenoic acid,2-hydroxy-3-phenoxypropyl ester

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Name

2-Propenoic acid,2-hydroxy-3-phenoxypropyl ester

EINECS 241-045-8
CAS No. 16969-10-1 Density 1.154g/cm3
PSA 55.76000 LogP 1.15550
Solubility 5.3g/L at 20℃ Melting Point N/A
Formula C12H14O4 Boiling Point 325.4 °C at 760 mmHg
Molecular Weight 222.241 Flash Point 146.1 °C
Transport Information N/A Appearance N/A
Safety 26 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 16969-10-1 (2-HYDROXY-3-PHENOXYPROPYL ACRYLATE) Hazard Symbols IrritantXi
Synonyms

2-Hydroxy-3-phenoxypropylacrylate;3-(Acryloyloxy)-2-hydroxypropyl phenyl ether;3-Phenoxy-2-hydroxypropyl acrylate;Aronix M 5700;Aronix M 5710;CN 131B;DA141;Doublemer DM 120;Epoxy Ester M 600A;Kayarad R 128;Kayarad R 128H;Laromer 8830;Light Acrylate M 600A;M 5700;M 600A;NK Ester 702A;Phenylglycidyl ether acrylate;R 128;R 128H;

Article Data 4

2-Propenoic acid,2-hydroxy-3-phenoxypropyl ester Specification

The 2-Propenoic acid,2-hydroxy-3-phenoxypropyl ester, with CAS registry number 16969-10-1, belongs to the following product categories: (1)Acrylate Carbonyl Compounds; (2)Acrylic Monomers; (3)C12 to C63; (4)Esters; (5)Monomers. It has the systematic name of 2-hydroxy-3-phenoxypropyl prop-2-enoate. And the chemical formula of this chemical is C12H14O4.

Physical properties of 2-Propenoic acid,2-hydroxy-3-phenoxypropyl ester: (1)ACD/LogP: 1.98; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.98; (4)ACD/LogD (pH 7.4): 1.98; (5)ACD/BCF (pH 5.5): 18.76; (6)ACD/BCF (pH 7.4): 18.76; (7)ACD/KOC (pH 5.5): 283.78; (8)ACD/KOC (pH 7.4): 283.77; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 44.76 Å2; (13)Index of Refraction: 1.526; (14)Molar Refractivity: 59.08 cm3; (15)Molar Volume: 192.4 cm3; (16)Polarizability: 23.42×10-24cm3; (17)Surface Tension: 42.2 dyne/cm; (18)Density: 1.154 g/cm3; (19)Flash Point: 146.1 °C; (20)Enthalpy of Vaporization: 66.36 kJ/mol; (21)Boiling Point: 380.9 °C at 760 mmHg; (22)Vapour Pressure: 1.76E-06 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
The 2-Propenoic acid,2-hydroxy-3-phenoxypropyl ester irritates to eyes, respiratory system and skin. If contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OCC(O)COc1ccccc1)\C=C
(2)InChI: InChI=1/C12H14O4/c1-2-12(14)16-9-10(13)8-15-11-6-4-3-5-7-11/h2-7,10,13H,1,8-9H2
(3)InChIKey: HHQAGBQXOWLTLL-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C12H14O4/c1-2-12(14)16-9-10(13)8-15-11-6-4-3-5-7-11/h2-7,10,13H,1,8-9H2
(5)Std. InChIKey: HHQAGBQXOWLTLL-UHFFFAOYSA-N

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