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
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
3.1416 1.6544 -0.0692 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3794 0.3609 -0.1416 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2673 -0.5786 -0.0967 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4656 -1.8379 -0.1647 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9456 -0.1797 0.0204 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0971 -1.1545 0.0586 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4213 -0.5378 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2717 -0.1359 -0.8277 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3970 0.3857 -0.2448 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1949 0.2841 1.1143 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0336 -0.2584 1.3092 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9611 2.3702 -0.1013 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1462 2.0297 0.0221 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3712 -0.0076 -0.2324 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0810 -1.9122 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0526 -1.6859 -0.9215 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0743 -0.2222 -1.8819 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2859 0.8027 -0.7302 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9304 0.6230 1.8525 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