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
   -1.6126   -0.3439   -2.4798 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1315    0.0805   -1.1414 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8781    0.9107   -0.4336 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1252   -0.3980   -0.6140 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8534   -1.1970   -1.2829 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5834   -0.0102    0.6280 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8142   -0.4659    1.1696 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0111    0.1366    2.5072 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1677    0.6326    3.5586 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2761   -1.2313   -2.4146 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2535    0.4730   -2.9139 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7200   -0.5108   -3.1109 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8333    1.2823   -0.8199 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5805    1.2575    0.5530 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7507   -1.5507    1.3017 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6743   -0.1529    0.5424 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3057    1.0875    4.5612 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