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
    2.9487   -0.2626    0.6361 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5055   -0.4452   -0.7884 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2618    0.3164   -1.1241 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1564   -0.0637   -0.3278 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0637    0.5628   -0.5321 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1300    1.4474   -1.4240 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2513    0.2128    0.2630 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3782    0.8510    0.0126 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1941   -0.8276    1.3194 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0692   -0.1963    0.7316 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5541   -1.0698    1.2913 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5823    0.7456    0.9707 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4027   -1.5241   -1.0511 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3189   -0.0573   -1.4359 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0611    0.1537   -2.2103 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4546    1.3864   -0.9019 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4028    1.6002   -0.7543 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2691    0.5942    0.6031 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2234   -1.0816    1.6243 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7503   -1.7599    0.8879 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6525   -0.4798    2.2099 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