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
    2.3292   -0.3636    0.3392 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9513   -0.4451    0.7357 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0671    0.0316   -0.0520 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2258    0.5551   -1.1551 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4752   -0.0345    0.3185 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4073    0.4463   -0.4919 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7098    0.4042   -0.1874 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0345    1.0105   -1.6904 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8793   -0.5836    1.4921 F   0  0  0  0  0  0  0  0  0  0  0  0
    2.4082   -0.6190   -0.7364 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7094    0.6651    0.5327 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9494   -1.0669    0.8950 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