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
    3.3359    1.7230    0.0591 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8918    0.5372    0.3940 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6363    0.0276   -0.1615 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9732    0.7382   -0.9727 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1654   -1.2289    0.1933 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0503   -1.6724   -0.3710 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1790   -0.7503   -0.0137 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4674   -0.9501   -0.4333 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2157    0.1002    0.0936 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3306    0.8849    0.8097 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1624    0.3293    0.7034 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7516    2.3307   -0.6462 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2592    2.0770    0.4785 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4443   -0.0715    1.0788 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0689   -1.7178   -1.4826 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3251   -2.6646    0.0183 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8799   -1.7493   -1.0535 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2936    0.2631   -0.0394 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6225    1.7938    1.3451 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