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
    3.6949   -0.1464   -0.0240 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3455   -0.2715   -0.7193 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2950    0.0435    0.3257 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0121   -0.0431   -0.2156 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0693    0.2266    0.6547 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8357    0.5281    1.8532 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4291    0.1514    0.1482 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4253    0.4050    0.9669 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7018   -0.2050   -1.2684 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7248   -0.9908    0.7148 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5383   -0.1908   -0.7154 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7597    0.7876    0.5811 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2551    0.3675   -1.6001 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2515   -1.3353   -1.0108 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3494   -0.6469    1.1755 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4117    1.0684    0.7323 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2106    0.6617    1.9900 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4617    0.3724    0.6762 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1210   -1.2274   -1.3671 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8371   -0.0383   -1.9302 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5221    0.4833   -1.6214 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