3,4-Epoxycyclohexylmethyl acrylate
Product Information
Molecular Formula
C10H14O3
Molecular Weight
182.22
Description
3,4-Epoxycyclohexylmethyl acrylate is widely used in the fusion of complex polymeric substances, encapsulated hydrogels and bioadhesives. Furthermore, the compound is an indispensable intermediate in the construction of pharmaceutical formulations, especially those targeting a variety of diseases through efficient drug delivery systems.
Synonyms
Acrylic Acid (3,4-Epoxycyclohexyl)methyl Ester (stabilized with HQ)||||7-Oxabicyclo[4.1.0]heptan-3-ylmethyl Acrylate (stabilized with HQ)||||Acrylic Acid 7-Oxabicyclo[4.1.0]heptan-3-ylmethyl Ester (stabilized with HQ)
IUPAC Name
7-oxabicyclo[4.1.0]heptan-3-ylmethyl prop-2-enoate
SMILES
C=CC(=O)OCC1CCC2C(C1)O2
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
InChI Key
DPTGFYXXFXSRIR-UHFFFAOYSA-N
Boiling Point
105 °C/2.4 mmHg
Flash Point
102 °C
Purity
>94.0%(GC)
Density
1.10
Appearance
Colorless to Light orange to Yellow clear liquid
Computed Properties
XLogP3
1.6
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
4
Exact Mass
182.094294304 g/mol
Monoisotopic Mass
182.094294304 g/mol
Topological Polar Surface Area
38.8Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
224
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
3
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
