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
   -1.8223   -1.1647   -1.4987 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4006   -0.4707   -0.2214 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3583   -0.2446    0.6754 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0446   -0.1233    0.0151 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2035    0.3728    1.2402 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0190   -0.1874   -0.7557 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3875    0.1180   -0.5067 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4032    1.1404    0.5459 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4300    1.9646    1.4084 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1613   -0.8229   -2.2823 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6781   -2.2227   -1.3550 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8649   -0.8401   -1.7495 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0002    0.2638    1.5977 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3434   -0.5168    0.5631 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7811    0.6671   -1.4061 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0123   -0.6898   -0.1817 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4371    2.7563    2.2457 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