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
    2.8091    1.7088    0.7455 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6793    0.8806    0.5676 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7546   -0.1902   -0.2778 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8878   -0.3733   -0.8715 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7313   -1.1493   -0.5924 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0025   -2.1402   -1.4182 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6031   -1.1040    0.0058 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5554   -0.0776   -0.5174 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8599   -0.3000    0.2922 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1483    1.3350   -0.2153 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4867    1.1898    1.4529 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2726    1.9178   -0.2357 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4839    2.6541    1.2508 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2409   -2.8558   -1.6537 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9750   -2.2294   -1.8501 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1161   -2.1216   -0.0812 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5596   -0.9470    1.1183 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7760   -0.2152   -1.6008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6709    0.1863    1.2740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7198    0.1314   -0.2323 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9546   -1.3854    0.5047 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9012    1.4069    0.8559 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3593    1.7188   -0.8985 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0996    1.9597   -0.3849 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