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
Resources
cid=

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
    2.3313    0.1532    0.1819 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0065    0.3123    0.6533 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0966   -0.0447   -0.1078 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1404   -0.5213   -1.2480 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4695    0.1179    0.3754 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4972   -0.2271   -0.3630 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7140    0.6295    1.5988 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.9780    0.0349    1.0934 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7006    1.0596   -0.3362 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4537   -0.7606   -0.4279 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3042   -0.6360   -1.3406 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5290   -0.1178   -0.0303 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