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
   -2.9365   -0.8057    0.2191 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7098    0.6558   -0.1375 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3571    0.7383   -0.8131 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3243    0.2862    0.0426 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9849    0.2855   -0.3970 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1985    0.6965   -1.5633 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1022   -0.1613    0.4162 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9517   -0.6041    1.6458 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4669   -0.1193   -0.1560 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6352   -0.9222    1.0719 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3199   -1.3171   -0.6978 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9473   -1.2524    0.4305 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7339    1.3062    0.7468 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4778    1.0311   -0.8372 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3441    0.1830   -1.7721 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0973    1.7938   -1.0759 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9890   -0.6651    2.1327 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8092   -0.9254    2.2121 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8472    0.9126   -0.0388 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3656   -0.3083   -1.2547 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1675   -0.8083    0.3357 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