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
   -0.1031   -2.8457    0.4909 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5749   -1.4755    0.2144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8866   -1.2454    0.1763 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4036   -0.4432   -0.0137 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6653   -0.6625    0.0268 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0951    0.8989   -0.3020 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1925    1.8297   -0.4934 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6118    3.1629   -0.7748 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1445    4.2872   -1.0175 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7637   -2.7860    1.1513 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9262   -3.4908    0.9141 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1627   -3.3795   -0.4682 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4965   -2.1534    0.3650 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3469   -0.3016   -0.0116 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7672    1.8434    0.4295 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7580    1.5264   -1.3884 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2301    5.2349   -1.2225 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