Monomers

Methyl 4-methyl-2-methylidenepentanoate

Identifiers

IUPAC name
methyl 4-methyl-2-methylidenepentanoate
InchI
InChI=1S/C8H14O2/c1-6(2)5-7(3)8(9)10-4/h6H,3,5H2,1-2,4H3
InchI Key
FVAWMVZVWUHHOB-UHFFFAOYSA-N
SMILES
COC(=O)C(=C)CC(C)C
Canonical SMILES
CC(C)CC(=C)C(=O)OC
Isomeric SMILES
CC(C)CC(=C)C(=O)OC
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C8H14O2
Heavy Atom Count
10
Molecular Weight
142.198
Exact Molecular Weight
142.0994
Valence Electrons
58
Radical Electrons
0
tPSA
26.3
MolLogP
1.7617
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

 24 23  0  0  0  0  0  0  0  0999 V2000
    4.2274   -0.2508   -0.6071 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9313   -0.6112   -0.2011 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8722    0.2668   -0.2255 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0954    1.4383   -0.6323 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5599   -0.1905    0.2136 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4293   -1.4293    0.6196 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5329    0.8004    0.1513 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8300    0.1646    0.5412 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9621    1.2081    0.4929 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1576   -0.8188   -0.5902 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2094    0.7661   -1.0310 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8615   -0.2564    0.3202 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6662   -0.9854   -1.3122 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2576   -2.1045    0.6343 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5301   -1.7771    0.9540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6215    1.1984   -0.8988 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2945    1.6908    0.7681 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7865   -0.2990    1.5226 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9103    1.8853    1.3602 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8467    1.7527   -0.4654 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9031    0.5982    0.4786 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6591   -1.6921   -0.1402 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8187   -0.2776   -1.2948 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2572   -1.0772   -1.1881 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  3  5  1  0
  5  6  2  3
  5  7  1  0
  7  8  1  0
  8  9  1  0
  8 10  1  0
  1 11  1  0
  1 12  1  0
  1 13  1  0
  6 14  1  0
  6 15  1  0
  7 16  1  0
  7 17  1  0
  8 18  1  0
  9 19  1  0
  9 20  1  0
  9 21  1  0
 10 22  1  0
 10 23  1  0
 10 24  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers