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2-Propenoic acid,1,1'-(1,3-propanediyl) ester

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Name

2-Propenoic acid,1,1'-(1,3-propanediyl) ester

EINECS 246-287-8
CAS No. 24493-53-6 Density 1.057 g/cm3
PSA 52.60000 LogP 0.83490
Solubility N/A Melting Point N/A
Formula C9H12O4 Boiling Point 243.1 °C at 760 mmHg
Molecular Weight 184.192 Flash Point 113.8 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 24493-53-6 (1,3-PROPANEDIOL DIACRYLATE) Hazard Symbols N/A
Synonyms

2-Propenoicacid, 1,3-propanediyl ester (9CI);1,3-Propanediol diacrylate;1,3-Propyleneglycol diacrylate;Trimethylene diacrylate;Trimethylene glycol diacrylate;Propane-1,3-diyl bisprop-2-enoate;Propane-1,3-diyl bisacrylate;

Article Data 7

2-Propenoic acid,1,1'-(1,3-propanediyl) ester Specification

The 2-Propenoic acid,1,1'-(1,3-propanediyl) ester, with the CAS registry number 24493-53-6, is also known as 1,3-Propanediol diacrylate. Its EINECS number is 246-287-8. It belongs to the product category of Monomer. This chemical's molecular formula is C9H12O4 and molecular weight is 184.19. What's more, its systematic name is Propane-1,3-diyl bisprop-2-enoate. 

Physical properties of 2-Propenoic acid,1,1'-(1,3-propanediyl) ester are: (1)ACD/LogP: 1.16; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.16; (4)ACD/LogD (pH 7.4): 1.16; (5)ACD/BCF (pH 5.5): 4.5; (6)ACD/BCF (pH 7.4): 4.5; (7)ACD/KOC (pH 5.5): 102.19; (8)ACD/KOC (pH 7.4): 102.19; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 52.6 Å2; (13)Index of Refraction: 1.449; (14)Molar Refractivity: 46.74 cm3; (15)Molar Volume: 174.2 cm3; (16)Polarizability: 18.53×10-24 cm3; (17)Surface Tension: 33 dyne/cm; (18)Density: 1.057 g/cm3; (19)Flash Point: 113.8 °C; (20)Enthalpy of Vaporization: 48.01 kJ/mol; (21)Boiling Point: 243.1 °C at 760 mmHg; (22)Vapour Pressure: 0.0327 mmHg at 25°C.

Preparation: this chemical can be prepared by acryloyl chloride and propane-1,3-diol at the temperature of 50 °C. This reaction will need reagents triethylamine, pyrogallol and solvent benzene with the reaction time of 0.5 hour. The yield is about 68%.

2-Propenoic acid,1,1'-(1,3-propanediyl) ester can be prepared by acryloyl chloride and propane-1,3-diol at the temperature of 50 °C

Uses of 2-Propenoic acid,1,1'-(1,3-propanediyl) ester: it can be used to produce C49H62N2O12•2C2H2O4 by heating. It will need solvent benzene with the reaction time of 48 hours. The yield is about 50%.

2-Propenoic acid,1,1'-(1,3-propanediyl) ester can be used to produce C49H62N2O12•2C2H2O4 by heating

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C=CC(=O)OCCCOC(=O)C=C
(2)InChI: InChI=1S/C9H12O4/c1-3-8(10)12-6-5-7-13-9(11)4-2/h3-4H,1-2,5-7H2
(3)InChIKey: GFLJTEHFZZNCTR-UHFFFAOYSA-N

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