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
    4.3251    0.7183    0.5045 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5114    0.2414   -0.4165 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1168   -0.0929   -0.0939 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7178    0.0823    1.0641 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2460   -0.5873   -1.0169 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0836   -0.9416   -0.8548 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0185    0.1360   -0.4231 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4101   -0.5099   -0.3224 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4301    0.5094    0.1109 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6476   -0.1173    0.1842 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5470    1.5519   -0.7809 F   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1385    0.9932    1.3790 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8103   -1.0026   -1.5528 F   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4166   -1.5486    0.5712 F   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7774    0.6459    0.8311 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1431    1.1315   -1.3732 F   0  0  0  0  0  0  0  0  0  0  0  0
    5.3352    0.9498    0.2290 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0141    0.8833    1.5193 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8394    0.0825   -1.4274 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4550   -1.2863   -1.8656 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2278   -1.8390   -0.2021 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