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
    3.6365    0.6572    0.5091 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9317    0.3124   -0.5445 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5963   -0.2707   -0.4457 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9539   -0.5878   -1.4910 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9647   -0.5078    0.7532 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3044   -1.0587    0.9383 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4000   -0.2973    0.3244 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9418   -0.5299   -0.9108 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9457    0.4136   -1.0980 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9621    1.1696    0.0312 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0231    0.7086    0.8508 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.6171    1.0846    0.4135 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2030    0.4994    1.4811 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3556    0.4657   -1.5234 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3405   -2.1522    0.6516 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4546   -1.1014    2.0605 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6923   -1.2861   -1.6594 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5511    0.4844   -1.9727 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6431    1.9965    0.1900 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