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
   -1.6895   -1.4057    0.6196 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6943   -0.0081    0.1691 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8506    0.5894   -0.0253 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4537    0.6955   -0.0558 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4806    1.8915   -0.4414 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7628    0.0406    0.1572 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9319    0.8076   -0.0882 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1405    0.0285    0.1649 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1425   -0.6127    0.3918 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4118   -1.5133    1.6996 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9774   -2.0329    0.0266 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6851   -1.8764    0.4886 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8027    0.0790    0.1377 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8583    1.6160   -0.3563 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9415    1.7450    0.5065 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9499    1.1246   -1.1643 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0349   -1.1686    0.6056 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