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
    4.3173    0.1396    0.0846 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1162   -0.3100   -0.1692 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9632    0.4617    0.2578 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1124    1.5685    0.8749 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6546    0.0755    0.0391 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4500    0.8513    0.4685 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7265    0.1960    0.1001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9156   -0.9975   -0.5655 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2765   -1.1947   -0.6788 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8534   -0.1011   -0.0707 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9171    0.6730    0.3630 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.1766   -0.4232   -0.2267 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4577    1.0688    0.6028 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9716   -1.2395   -0.6875 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4590    0.9527    1.5818 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3683    1.8892    0.0769 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0978   -1.6111   -0.9055 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7625   -2.0371   -1.1496 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9429    0.0378    0.0040 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