Monomers

2,2,3,3,4,4,4-Heptafluorobutyl acrylate

Identifiers

IUPAC name
2,2,3,3,4,4,4-heptafluorobutyl prop-2-enoate
InchI
InChI=1S/C7H5F7O2/c1-2-4(15)16-3-5(8,9)6(10,11)7(12,13)14/h2H,1,3H2
InchI Key
PLXOUIVCSUBZIX-UHFFFAOYSA-N
SMILES
C=CC(=O)OCC(C(C(F)(F)F)(F)F)(F)F
Canonical SMILES
C=CC(=O)OCC(C(C(F)(F)F)(F)F)(F)F
Isomeric SMILES
C=CC(=O)OCC(C(C(F)(F)F)(F)F)(F)F
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C7H5F7O2
Heavy Atom Count
16
Molecular Weight
254.101
Exact Molecular Weight
254.0178
Valence Electrons
94
Radical Electrons
0
tPSA
26.3
MolLogP
2.5485
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

 21 20  0  0  0  0  0  0  0  0999 V2000
    4.7298   -0.1186    0.2689 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5407   -0.5803    0.5937 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3331    0.0960    0.0837 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4451    1.1055   -0.6553 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0765   -0.3629    0.4057 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0520    0.3168   -0.1058 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3426   -0.3526    0.3702 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4774    0.4227   -0.2115 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8292   -0.1335    0.1807 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7755    0.6950   -0.4375 F   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0493   -0.1318    1.5233 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9983   -1.4056   -0.3231 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3918    0.3543   -1.5816 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3397    1.7419    0.1476 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3569   -0.3803    1.7469 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2861   -1.6552   -0.0786 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.6056   -0.6239    0.6496 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8403    0.7383   -0.3582 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4198   -1.4443    1.2259 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0053    0.3552   -1.1964 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0972    1.3633    0.2677 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  3
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
  9 11  1  0
  9 12  1  0
  8 13  1  0
  8 14  1  0
  7 15  1  0
  7 16  1  0
  1 17  1  0
  1 18  1  0
  2 19  1  0
  6 20  1  0
  6 21  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers