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
   -1.5936   -1.4144   -0.5487 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4849   -0.3065    0.4588 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5856    0.1534    0.9530 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1513    0.3073    0.6556 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0310    1.3770    1.2242 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9636   -0.3886    0.1611 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2811    0.0189    0.1588 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4678    0.9072   -1.0619 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6271    1.5949   -1.9898 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5905   -1.4370   -0.9813 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8251   -1.2127   -1.3003 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3792   -2.3840    0.0301 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5430   -0.1783    0.6977 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5664    0.9780    1.6813 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9595   -0.8352    0.0426 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6277    0.6010    1.0339 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7619    2.2192   -2.8553 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