Monomers

Propargyl methacrylate

Identifiers

IUPAC name
prop-2-ynyl 2-methylprop-2-enoate
InchI
InChI=1S/C7H8O2/c1-4-5-9-7(8)6(2)3/h1H,2,5H2,3H3
InchI Key
PZAWASVJOPLHCJ-UHFFFAOYSA-N
SMILES
CC(=C)C(=O)OCC#C
Canonical SMILES
CC(=C)C(=O)OCC#C
Isomeric SMILES
CC(=C)C(=O)OCC#C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C7H8O2
Heavy Atom Count
9
Molecular Weight
124.139
Exact Molecular Weight
124.0524
Valence Electrons
48
Radical Electrons
0
tPSA
26.3
MolLogP
0.7389
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

 17 16  0  0  0  0  0  0  0  0999 V2000
   -2.7317    1.0284   -0.0620 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5840    0.4169    0.7687 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6600    0.1721    1.9310 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4271    0.1526   -0.1189 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5419    0.4398   -1.3691 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7815   -0.3731    0.2838 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7427   -0.5664   -0.7375 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0462   -0.8223   -0.3887 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2078   -1.0592   -0.0976 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2279    1.8191   -0.6478 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1521    0.2361   -0.6859 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4438    1.4712    0.6818 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7566   -0.0427    2.9982 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4606   -0.4561    2.0266 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2864   -1.4447   -1.3665 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6519    0.2986   -1.4878 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2691   -1.2703    0.1871 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  3
  2  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  3  0
  1 10  1  0
  1 11  1  0
  1 12  1  0
  3 13  1  0
  3 14  1  0
  7 15  1  0
  7 16  1  0
  9 17  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers