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
-2.1051 0.4793 0.4088 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6781 0.5000 0.4223 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0416 -0.5666 -0.0988 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6267 -1.5255 -0.5704 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4975 -0.5973 -0.1105 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2032 0.3863 0.3732 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1371 -1.6667 -0.6332 F 0 0 0 0 0 0 0 0 0 0 0 0
-2.5167 1.4587 0.1121 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4833 0.1153 1.3848 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4570 -0.2640 -0.3458 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2829 0.4169 0.3908 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7046 1.2634 0.8021 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