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
    3.4744   -0.2378   -0.2820 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0157    0.1311   -0.5565 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2899   -0.0844    0.7478 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0459    0.2301    0.6082 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8872   -0.4240   -0.2411 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4635   -1.3639   -0.9411 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2770   -0.0284   -0.3326 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0907   -0.6714   -1.1632 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7624    1.0936    0.5095 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9737   -0.5282   -1.2306 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9472    0.6349    0.1900 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5326   -1.0920    0.4224 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6040   -0.5148   -1.3302 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9369    1.1908   -0.8830 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4724   -1.1377    1.0525 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7958    0.5438    1.5149 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7054   -1.4833   -1.7617 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1269   -0.4174   -1.2679 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8756    1.0341    0.5177 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4311    2.0783    0.0923 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3768    1.0466    1.5493 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