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
    3.5376   -0.0453   -0.1299 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0815   -0.3728    0.1469 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2659    0.2468   -0.9502 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1192    0.0127   -0.8076 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8651    0.4105    0.2676 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3349    1.0242    1.2118 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2776    0.1166    0.3078 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9915    0.4979    1.3379 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9369   -0.6170   -0.8101 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1137    0.1277    0.8070 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9659   -0.8455   -0.7563 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5699    0.9410   -0.6722 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9802   -1.4775    0.1098 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8509    0.0431    1.1452 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5312    1.3045   -1.0424 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5706   -0.2509   -1.9025 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0406    0.2792    1.3669 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5263    1.0264    2.1473 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3972    0.1031   -1.5264 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2380   -1.2778   -1.3548 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7403   -1.2470   -0.4123 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