Monomers

N-Propyl methacrylate

Identifiers

IUPAC name
propyl 2-methylprop-2-enoate
InchI
InChI=1S/C7H12O2/c1-4-5-9-7(8)6(2)3/h2,4-5H2,1,3H3
InchI Key
NHARPDSAXCBDDR-UHFFFAOYSA-N
SMILES
CCCOC(=O)C(=C)C
Canonical SMILES
CCCOC(=O)C(=C)C
Isomeric SMILES
CCCOC(=O)C(=C)C
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C7H12O2
Heavy Atom Count
9
Molecular Weight
128.171
Exact Molecular Weight
128.0837
Valence Electrons
52
Radical Electrons
0
tPSA
26.3
MolLogP
1.5157
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

 21 20  0  0  0  0  0  0  0  0999 V2000
    2.7194    0.2032    0.6149 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3994    0.1422   -0.8473 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2250   -0.6589   -1.2314 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0230   -0.3557   -0.8000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6684   -0.3244    0.3813 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0235   -0.6562    1.3998 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0604    0.0660    0.5663 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5999    0.0633    1.7644 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8505    0.4635   -0.6166 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6045   -0.7879    1.0769 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7699    0.5921    0.7771 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0602    0.9612    1.0788 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3368    1.2155   -1.2040 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3307   -0.2732   -1.3527 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1797   -0.6683   -2.3765 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5087   -1.7550   -1.0453 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0535   -0.2226    2.6631 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6297    0.3478    1.9331 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8211    0.9267   -0.3044 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1146   -0.4529   -1.2026 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2897    1.1736   -1.2749 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  2  3
  7  9  1  0
  1 10  1  0
  1 11  1  0
  1 12  1  0
  2 13  1  0
  2 14  1  0
  3 15  1  0
  3 16  1  0
  8 17  1  0
  8 18  1  0
  9 19  1  0
  9 20  1  0
  9 21  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers