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
    3.4303    0.8170    0.7113 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3336   -0.4939    0.5665 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0596   -1.1178    0.2837 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0008   -2.3761    0.1507 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8769   -0.4239    0.1454 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3409   -1.0905   -0.1317 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4408   -0.0651   -0.2233 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7723   -0.2853   -0.4766 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4386    0.9231   -0.4748 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4356    1.8602   -0.2087 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2988    1.2230   -0.0729 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5612    1.4646    0.6231 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3640    1.3094    0.9220 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2365   -1.0758    0.6670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2578   -1.6682   -1.0794 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5457   -1.8119    0.6930 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2234   -1.2554   -0.6498 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4874    1.1335   -0.6369 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6216    2.9333   -0.1364 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