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
    0.0721   -1.7268   -1.8036 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8788   -0.6552   -1.1724 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0074   -0.3147   -1.7662 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4327   -0.0119    0.0538 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0756    0.8952    0.6244 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7604   -0.4079    0.6358 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2046    0.2179    1.8381 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3877    1.6616    1.6251 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5374    2.8521    1.4706 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0576   -1.5219   -2.9019 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9510   -1.6908   -1.3622 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5172   -2.7290   -1.6017 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6638    0.4667   -1.3679 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3555   -0.7798   -2.6760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4082    0.0724    2.5849 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1583   -0.2239    2.1610 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6531    3.8962    1.3455 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