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
   -3.6012   -0.1989    0.8410 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6564    0.6599    1.1712 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4343    0.6945    0.3762 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5404    1.5136    0.6961 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2030   -0.1139   -0.6997 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0236   -0.0471   -1.4285 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2106   -0.3196   -0.6806 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0767    0.6254   -0.1832 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1113   -0.0396    0.4547 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8134   -1.3844    0.3084 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6968   -1.5011   -0.3598 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5195   -0.8830    0.0084 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5315   -0.2614    1.4051 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7868    1.3202    2.0100 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1067   -0.8227   -2.2473 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0785    0.9185   -2.0065 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0218    1.6905   -0.2443 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9764    0.3650    0.9647 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4178   -2.2159    0.6918 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