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
   -1.1762   -2.1494    0.7023 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3419   -0.6455    0.8139 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5177   -0.3260    1.3361 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5029    0.3242    0.2599 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8212    1.5737    0.1326 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8451    0.1255   -0.2702 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3859    1.3122   -0.8314 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6846    1.2910   -1.1955 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8745    1.2527   -1.5407 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8143   -2.6397    1.4909 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1342   -2.3652    0.8726 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5244   -2.5265   -0.2790 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2293   -1.0365    1.6189 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6516    0.7955    1.4704 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6876    1.7328   -1.6126 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2461    2.0717    0.0284 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9898    1.2095   -1.8738 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