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
-2.1316 0.6332 -0.1830 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5255 -0.6303 0.4379 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1313 -0.4365 0.5873 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6613 -0.1831 -0.5238 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0656 -0.1408 -1.6318 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1040 0.0243 -0.4267 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7184 -0.0212 0.7316 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7718 0.2637 -1.5785 F 0 0 0 0 0 0 0 0 0 0 0 0
-1.3276 1.4044 -0.3182 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5015 0.4092 -1.1995 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8953 1.0826 0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7663 -1.5069 -0.2073 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9691 -0.8196 1.4452 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1474 -0.2151 1.6259 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7798 0.1362 0.7629 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