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
-2.1303 0.2775 0.7340 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5574 -0.4794 -0.4495 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1340 -0.6049 -0.3412 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6639 0.5153 -0.2845 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0864 1.6359 -0.3320 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1254 0.4228 -0.1734 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6774 -0.7773 -0.1275 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8552 1.5581 -0.1219 F 0 0 0 0 0 0 0 0 0 0 0 0
-2.9846 -0.2580 1.1983 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2978 0.3894 1.4755 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4020 1.3062 0.4200 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8155 0.0274 -1.4026 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9692 -1.5096 -0.3832 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7755 -0.8089 -0.0442 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1069 -1.6946 -0.1677 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