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
   -2.5442    0.8617    0.4903 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3625    0.0561    0.1420 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2867   -1.1222    1.1464 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2703    0.0199   -0.6479 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1523    0.6799   -1.6863 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7198   -0.9454   -0.3146 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9247   -1.3985   -0.6762 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5981    0.2354   -0.3795 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1468    1.5921   -0.1104 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5188    1.8376    0.8596 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1666    0.9563   -0.6108 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3810    0.2610    1.0097 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1233   -0.9908    1.8089 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5394   -1.7814    0.8910 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4322   -1.2080   -1.7251 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6494   -1.7194    0.0377 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5694    2.6658    0.0851 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