CAS No.64630-63-3,3,4-Epoxycyclohexylmethyl acrylate Suppliers

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Basic Information

Molecular Structure:
CAS No.:	64630-63-3
Name:	3,4-Epoxycyclohexylmethyl acrylate

Formula:	C₁₀H₁₄O₃
Molecular Weight:	182.219
Synonyms:	Acrylicacid, 7-oxabicyclo[4.1.0]hept-3-ylmethyl ester (6CI);3,4-Epoxyhexahydrobenzyl acrylate;Cyclomer A 400;
Density:	1.102 g/cm³
Boiling Point:	257.969 °C at 760 mmHg
Flash Point:	102.034 °C
PSA:	38.83000
LogP:	1.28310

Synthetic route

: 21367-02-2
1-acryloyloxymethyl-3-cyclohexene

: 64630-63-3
1-acryloyloxymethyl-3,4-epoxycyclohexane

Conditions

Conditions	Yield
With dihydrogen peroxide; sodium acetate; acetic anhydride In water at 10℃; for 0.416667h;	99.2%
With peracetic acid; sodium acetate In benzene at 30 - 35℃; for 2.5h;

: 79-21-0
peracetic acid

: 21367-02-2
1-acryloyloxymethyl-3-cyclohexene

: 64630-63-3
1-acryloyloxymethyl-3,4-epoxycyclohexane

Conditions

Conditions	Yield
With ethyl acetate
With acetone

: 72581-32-9, 1679-51-2
cyclohex-3-enylmethanol

: 64630-63-3
1-acryloyloxymethyl-3,4-epoxycyclohexane

Conditions

Conditions	Yield
Multi-step reaction with 2 steps 1: sulfuric acid, 3-tert-butyl-1,2-dihydroxybenzene / benzene / Heating 2: 40-45percent aq. peracetic acid, sodium acetate / benzene / 2.5 h / 30 - 35 °C View Scheme

: 64630-63-3
1-acryloyloxymethyl-3,4-epoxycyclohexane

: 1072-71-5
2,5-Dimercapto-1,3,4-thiadiazole

: C22H30N2O6S3

Conditions

Conditions	Yield
With 2,5-bis(1,1-dimethylethyl)-1,4-benzenediol at 60℃; for 3h;	99.6%

: methacrylic acid 7-oxabicyclo[4.1.0]hept-3-ylmethyl ester

: 64630-63-3
1-acryloyloxymethyl-3,4-epoxycyclohexane

: 1072-71-5
2,5-Dimercapto-1,3,4-thiadiazole

: C23H32N2O6S3

Conditions

Conditions	Yield
With 2,5-bis(1,1-dimethylethyl)-1,4-benzenediol In isopropyl alcohol at 70℃; for 4h;	98.9%

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Specification

The 2-Propenoic acid,7-oxabicyclo[4.1.0]hept-3-ylmethyl ester, with the CAS registry number 64630-63-3, is also known as 7-Oxabicyclo[4.1.0]hept-3-ylmethyl acrylate. This chemical's molecular formula is C₁₀H₁₄O₃ and molecular weight is 182.22. What's more, its IUPAC name is called 7-Oxabicyclo[4.1.0]heptan-4-ylmethyl prop-2-enoate.

Physical properties about 2-Propenoic acid,7-oxabicyclo[4.1.0]hept-3-ylmethyl ester are: (1)ACD/LogP: 1.708; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.71; (4)ACD/LogD (pH 7.4): 1.71; (5)ACD/BCF (pH 5.5): 11.70; (6)ACD/BCF (pH 7.4): 11.70; (7)ACD/KOC (pH 5.5): 202.45; (8)ACD/KOC (pH 7.4): 202.45; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 38.83 Å²; (13)Index of Refraction: 1.485; (14)Molar Refractivity: 47.421 cm³; (15)Molar Volume: 165.417 cm³; (16)Polarizability: 18.799×10^-24cm³; (17)Surface Tension: 38.111 dyne/cm; (18)Density: 1.102 g/cm³; (19)Flash Point: 102.034 °C; (20)Enthalpy of Vaporization: 49.555 kJ/mol; (21)Boiling Point: 257.969 °C at 760 mmHg; (22)Vapour Pressure: 0.014 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: C=CC(=O)OCC1CC2OC2CC1
(2) InChI: InChI=1S/C10H14O3/c1-2-10(11)12-6-7-3-4-8-9(5-7)13-8/h2,7-9H,1,3-6H2
(3) InChIKey: DPTGFYXXFXSRIR-UHFFFAOYSA-N