Monomers
Methyl 2-fluoroacrylate
Identifiers
IUPAC name
methyl 2-fluoroprop-2-enoate
InchI
InChI=1S/C4H5FO2/c1-3(5)4(6)7-2/h1H2,2H3
InchI Key
ZTZJVAOTIOAZGZ-UHFFFAOYSA-N
SMILES
COC(=O)C(=C)F
Canonical SMILES
COC(=O)C(=C)F
Isomeric SMILES
COC(=O)C(=C)F
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C4H5FO2
Heavy Atom Count
7
Molecular Weight
104.08
Exact Molecular Weight
104.0274
Valence Electrons
40
Radical Electrons
0
tPSA
26.3
MolLogP
0.6426
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
12 11 0 0 0 0 0 0 0 0999 V2000
2.3360 -0.0917 0.0573 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0630 -0.5884 -0.2431 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1128 0.0696 0.0869 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0161 1.1594 0.6820 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4344 -0.4502 -0.2273 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4886 0.2394 0.1229 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6136 -1.6304 -0.8735 F 0 0 0 0 0 0 0 0 0 0 0 0
2.3008 0.9663 0.4389 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9580 -0.0447 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8662 -0.6779 0.8342 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3892 1.1765 0.6350 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4693 -0.1279 -0.1002 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 2 0
3 5 1 0
5 6 2 3
5 7 1 0
1 8 1 0
1 9 1 0
1 10 1 0
6 11 1 0
6 12 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers