Monomers

Furfuryl acrylate

Identifiers

IUPAC name
furan-2-ylmethyl prop-2-enoate
InchI
InChI=1S/C8H8O3/c1-2-8(9)11-6-7-4-3-5-10-7/h2-5H,1,6H2
InchI Key
BHPLCUDMENJIRS-UHFFFAOYSA-N
SMILES
C=CC(=O)OCc1ccco1
Canonical SMILES
C=CC(=O)OCC1=CC=CO1
Isomeric SMILES
C=CC(=O)OCC1=CC=CO1
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H8O3
Heavy Atom Count
11
Molecular Weight
152.149
Exact Molecular Weight
152.0473
Valence Electrons
58
Radical Electrons
0
tPSA
39.44
MolLogP
1.5088
H Bond Acceptors
3
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
1
Aliphatic Rings
0
Aromatic Rings
1

MOL File


     RDKit          3D

 19 19  0  0  0  0  0  0  0  0999 V2000
    3.3837    0.6749    1.3348 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7769   -0.2721    0.6481 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5830    0.0141   -0.1670 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1516    1.1895   -0.1942 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9294   -0.9461   -0.8917 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2128   -0.6961   -1.6774 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2863   -0.1671   -0.7625 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2004   -0.9635   -0.1039 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9883   -0.0834    0.6151 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5355    1.1973    0.3744 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5226    1.0846   -0.4515 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0376    1.7068    1.3352 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2551    0.4451    1.9245 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1800   -1.2709    0.6983 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5209   -1.6405   -2.1356 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0095    0.0740   -2.4431 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2643   -2.0522   -0.1575 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8102   -0.3949    1.2464 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9654    2.1007    0.8075 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11  7  1  0
  1 12  1  0
  1 13  1  0
  2 14  1  0
  6 15  1  0
  6 16  1  0
  8 17  1  0
  9 18  1  0
 10 19  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers