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
-2.0966 -0.5734 0.1001 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7193 0.7334 -0.5520 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4680 0.5643 -1.1691 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6396 0.2097 -0.4019 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5517 0.0366 0.8272 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9213 0.0400 -1.0561 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9738 -0.2952 -0.3379 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0440 0.2236 -2.3994 F 0 0 0 0 0 0 0 0 0 0 0 0
-1.6607 -1.4033 -0.5225 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1979 -0.6763 0.1545 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6832 -0.5867 1.1226 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6689 1.5714 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4461 1.0243 -1.3438 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9559 -0.4330 -0.7895 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8546 -0.4354 0.7232 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