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

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
    3.7640   -0.3578   -0.2703 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3290   -0.8165   -0.2935 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3476    0.3031   -0.0869 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0484   -0.2501   -0.1294 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0264    0.6047    0.0392 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7918    1.8211    0.2202 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3914    0.0974    0.0059 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6282   -1.1911   -0.1862 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4988    1.0710    0.1940 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1106   -0.0277    0.7146 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3920   -1.2158   -0.5835 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8766    0.4121   -1.0688 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1405   -1.2304   -1.3166 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1413   -1.5865    0.4933 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5050    0.7430    0.9370 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4306    1.0812   -0.8611 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6538   -1.5208   -0.2032 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8205   -1.8900   -0.3217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3127    1.8993   -0.5330 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4887    0.6193    0.0098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4733    1.4344    1.2431 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