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
    3.4913   -0.6834    0.0934 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0767   -0.2084    0.3421 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3669   -0.0538   -0.9789 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0360    0.3881   -0.8538 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9691   -0.2830   -0.1686 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6343   -1.3685    0.3719 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3302    0.2191   -0.0692 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2118   -0.4925    0.6040 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7326    1.4933   -0.7009 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4477   -1.7060   -0.3657 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9450   -0.0297   -0.6785 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0807   -0.7402    1.0188 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1294    0.7878    0.8532 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5720   -0.9370    0.9741 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4391   -1.0426   -1.4944 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8802    0.6659   -1.6499 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2522   -0.1775    0.7204 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9673   -1.4310    1.0843 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6413    1.9250   -0.2451 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9214    2.2607   -0.5305 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8048    1.4135   -1.8117 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