Monomers
Ethyl 2-Fluoroacrylate
Identifiers
IUPAC name
ethyl 2-fluoroprop-2-enoate
InchI
InChI=1S/C5H7FO2/c1-3-8-5(7)4(2)6/h2-3H2,1H3
InchI Key
DJMOYRIAWTXGEY-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)F
Canonical SMILES
CCOC(=O)C(=C)F
Isomeric SMILES
CCOC(=O)C(=C)F
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H7FO2
Heavy Atom Count
8
Molecular Weight
118.107
Exact Molecular Weight
118.043
Valence Electrons
46
Radical Electrons
0
tPSA
26.3
MolLogP
1.0327
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
15 14 0 0 0 0 0 0 0 0999 V2000
-2.3115 -1.5769 -0.3126 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5263 -0.3084 -0.2805 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1415 -0.5124 -0.4747 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6969 0.5713 -0.4683 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1901 1.7280 -0.2861 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1390 0.4757 -0.6585 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9016 1.5473 -0.6439 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7091 -0.7296 -0.8536 F 0 0 0 0 0 0 0 0 0 0 0 0
-2.8287 -1.7100 0.6528 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6251 -2.4289 -0.4637 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0892 -1.6026 -1.1015 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9378 0.4124 -1.0312 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6393 0.1641 0.7128 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9619 1.4225 -0.7893 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5006 2.5475 -0.4911 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 2 0
4 6 1 0
6 7 2 3
6 8 1 0
1 9 1 0
1 10 1 0
1 11 1 0
2 12 1 0
2 13 1 0
7 14 1 0
7 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers