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
   -2.0358    1.0210   -1.0350 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1966   -0.1849   -1.1767 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4370   -1.0267   -2.1547 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1009   -0.4743   -0.2591 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6126   -1.4977   -0.3780 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1405    0.4215    0.7664 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1939    0.1785    1.6789 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4965    0.1056    1.0140 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5668    0.0404    0.4858 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8168    0.8300   -0.2665 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5772    1.2142   -1.9894 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4433    1.9333   -0.8332 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2393   -0.8264   -2.8366 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8512   -1.9157   -2.2941 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0003   -0.7966    2.2103 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1581    0.9930    2.4321 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5295   -0.0152    0.0253 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