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
    3.3317    0.5166    1.7003 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7861   -0.4342    0.9706 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6468   -0.1358    0.0762 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1875    1.0387    0.0061 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0571   -1.0979   -0.6944 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0299   -0.8842   -1.5674 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1934   -0.3747   -0.7580 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4451   -0.0420   -1.2255 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2025    0.3774   -0.1534 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3592    0.2788    0.9421 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2115   -0.1602    0.5383 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9853    1.5358    1.6842 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1611    0.2790    2.3458 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1379   -1.4570    0.9903 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3546   -1.8784   -1.9472 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2080   -0.1878   -2.3959 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7747   -0.1007   -2.2574 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2265    0.7046   -0.1936 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7041    0.5516    1.9389 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