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
   -1.6090   -0.9635    1.6491 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2139    0.3456    1.0634 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7789    1.4237    1.5910 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2678    0.4313   -0.0184 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1027    1.5058   -0.5514 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2746   -0.7324   -0.5113 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2065   -0.8105   -1.5599 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4339   -0.1107   -1.3030 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4609    0.4783   -1.1085 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8984   -1.7717    1.3598 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6410   -0.9273    2.7582 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6200   -1.2376    1.2959 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4987    2.3743    1.1732 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4890    1.3829    2.4006 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6933   -0.4835   -2.4884 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4568   -1.9052   -1.6717 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3881    1.0006   -0.9477 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