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
    3.5766    0.2430    0.0022 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1657   -0.3070    0.0714 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2824    0.4457   -0.8311 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0370    0.1273   -0.9356 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9181    0.1594    0.1143 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3866    0.5135    1.1906 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3251   -0.1708    0.0455 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9121   -0.5463   -1.0718 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1482   -0.0869    1.2734 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8575    0.3393   -1.0618 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2356   -0.5578    0.4301 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6884    1.1967    0.5602 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8910   -0.3980    1.1072 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2517   -1.3640   -0.3223 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3433    1.5328   -0.5142 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7438    0.4545   -1.8503 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9558   -0.7889   -1.1126 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3310   -0.6130   -1.9730 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1967    0.9899    1.5502 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1696   -0.4799    1.1275 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6559   -0.6895    2.0807 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