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
   -2.5749    1.5372   -0.1329 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4521    0.5267   -0.3054 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6112   -0.5946   -0.8187 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1370    0.9340    0.2571 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1638    1.9472    0.7609 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8581   -0.1107    0.1573 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1416   -0.0828    0.5850 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6870   -1.4928    0.1846 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1061   -2.5880   -0.1475 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4346    1.2227   -0.7010 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2147    2.5301   -0.4509 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7959    1.5352    0.9658 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5845   -1.0381   -1.2274 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8332   -1.3723   -1.0189 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3396    0.0558    1.6492 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8275    0.5988   -0.0080 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5141   -3.6085   -0.4699 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