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
    3.8053    0.4009   -1.0870 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7804   -0.4782   -0.6013 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6203    0.0560   -0.0598 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5307    1.3137   -0.0248 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5405   -0.7708    0.4514 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6828   -2.0797    0.3919 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6894   -0.2236    1.0259 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4685    0.6344    0.0595 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8918   -0.1193   -1.1715 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7588    1.0400    0.7829 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0302    1.1585   -0.2799 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4895    0.9538   -1.9747 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7293   -0.1447   -1.3008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0745   -2.7618    0.7511 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5650   -2.5437   -0.0194 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3874    0.4695    1.8661 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3221   -0.9905    1.5112 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8859    1.5043   -0.2318 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6323   -0.9227   -0.9132 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4668    0.6046   -1.7973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0433   -0.5171   -1.7515 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5009    1.7126    1.6284 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3756    1.5836    0.0591 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2767    0.1200    1.1195 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