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
   -1.6932    1.4398    1.9648 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7191    1.1467    0.8824 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0753    2.1207    0.2709 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4578   -0.2224    0.4775 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0282   -1.2178    1.0087 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4453   -0.5187   -0.5292 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6935   -1.8490   -0.9151 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6928   -1.8967   -2.0080 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5063   -1.9244   -2.8974 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1929    0.4999    2.2653 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4741    2.1555    1.6399 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1350    1.8957    2.8146 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6287    1.8793   -0.5143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2374    3.1673    0.5403 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2755   -2.2722   -1.2493 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0977   -2.4383   -0.0560 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2243   -1.9656   -3.6950 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