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
   -0.2721    0.8313    2.1822 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8010    1.0203    0.8145 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5397    2.0627    0.5441 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4854    0.0381   -0.2015 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9034    0.1420   -1.3812 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2976   -1.0505    0.1225 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.6673   -2.0645   -0.7796 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4268   -1.4545   -1.8813 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0590   -0.9484   -2.7765 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9056    1.3877    2.8854 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7985    1.1115    2.2318 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3421   -0.2495    2.4775 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8109    2.8245    1.2431 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9329    2.2022   -0.4760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1985   -2.5866   -1.2272 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3226   -2.7865   -0.2097 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6199   -0.4798   -3.5682 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