Monomers

Methyl 2,3,3-trifluoroacrylate

Identifiers

IUPAC name
methyl 2,3,3-trifluoroprop-2-enoate
InchI
InChI=1S/C4H3F3O2/c1-9-4(8)2(5)3(6)7/h1H3
InchI Key
LOYYAPWQNHOYQA-UHFFFAOYSA-N
SMILES
COC(=O)C(=C(F)F)F
Canonical SMILES
COC(=O)C(=C(F)F)F
Isomeric SMILES
COC(=O)C(=C(F)F)F
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4H3F3O2
Heavy Atom Count
9
Molecular Weight
140.06
Exact Molecular Weight
140.0085
Valence Electrons
52
Radical Electrons
0
tPSA
26.3
MolLogP
1.237
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
    2.3273    0.2168    0.1027 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0987   -0.1707    0.6715 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0764    0.0290   -0.0546 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0110    0.5495   -1.1981 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3497   -0.3751    0.5407 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4493   -0.1835   -0.1493 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3825    0.3714   -1.3691 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6374   -0.5395    0.3592 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3787   -0.9380    1.7873 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.3223    1.3295    0.0585 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1609   -0.1383    0.7407 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3758   -0.1511   -0.9254 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
  6  7  1  0
  6  8  1  0
  5  9  1  0
  1 10  1  0
  1 11  1  0
  1 12  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers