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
   -2.7531   -0.6417    0.7475 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2911   -0.7450    0.6205 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6679   -1.7658    1.1500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5550    0.2755   -0.0824 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1935    1.2544   -0.5857 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8333    0.2349   -0.2345 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4348    1.2830   -0.9362 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8907    1.0544   -0.9812 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0724    0.8800   -1.0266 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2778   -1.3837    0.1048 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1301    0.3707    0.4371 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0113   -0.8439    1.8167 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1978   -2.5643    1.6954 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4115   -1.8225    1.0445 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0209    1.4694   -1.9265 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2720    2.2139   -0.3175 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1419    0.7307   -1.0844 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