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
   -0.2804   -0.5202    2.4159 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0413    0.0286    1.2688 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2052    0.6092    1.4856 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4628   -0.0966   -0.0596 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0480    0.3470   -1.1065 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7609   -0.7032   -0.2862 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3855   -0.8634   -1.5154 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6377    0.4129   -2.1284 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8397    1.5164   -2.6408 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1968    0.2834    3.0297 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0359   -1.0276    3.0720 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4748   -1.2367    2.0480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7687    1.0126    0.6560 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5712    0.6721    2.4934 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3227   -1.4494   -1.3492 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7639   -1.4583   -2.2445 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0316    2.4731   -3.0768 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