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
   -2.7057   -0.4659   -1.2213 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6410   -0.0711    0.2168 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4742    0.7970    0.5575 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2368    0.1600    0.2783 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9885    0.7420    0.5006 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0180    1.9015    0.9770 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2662    0.0999    0.2187 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4144    0.6987    0.4490 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2448   -1.2747   -0.3463 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7767   -0.6301   -1.4972 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2165   -1.4614   -1.3196 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2527    0.2585   -1.9168 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5652    0.5026    0.4520 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6467   -0.9882    0.8469 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4883    0.9654    1.6580 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5604    1.7876    0.0888 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3385    0.1961    0.2295 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4601    1.6919    0.8568 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1345   -1.2866   -1.4364 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4768   -1.8450    0.1971 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2224   -1.7783   -0.1150 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