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
    3.6720    0.5984    0.2407 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2155    1.0304    0.0620 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3782   -0.2213    0.2212 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0014    0.1104    0.0655 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9779   -0.8746    0.1682 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5650   -2.0398    0.4008 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4045   -0.5758    0.0150 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2696   -1.5437    0.1227 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8994    0.7937   -0.2590 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2712    1.2665   -0.4145 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0145    0.7782    1.2776 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7860   -0.4799   -0.0486 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0361    1.4762   -0.9300 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9880    1.7853    0.8379 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6481   -0.9285   -0.5716 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5811   -0.6962    1.1957 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3142   -1.3406    0.0132 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9407   -2.5442    0.3206 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7092    1.0065    0.4783 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1073    1.5490   -0.2245 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4016    0.8502   -1.2663 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