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
    3.9043    0.0494   -0.5041 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7624   -0.7481   -0.2146 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5884   -0.1098    0.1305 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5792    1.1301    0.1733 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4248   -0.9095    0.4258 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5759   -2.2453    0.3611 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9036   -0.4030    0.8244 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7177    0.2675   -0.2061 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1890    1.4902   -0.8546 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0867    0.5158    0.4469 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8765    0.4056   -1.5728 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8753    0.9124    0.1832 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8436   -0.5093   -0.3445 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5405   -2.6224    0.0973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2696   -2.8661    0.5748 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5291   -1.2616    1.2139 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8339    0.2734    1.7211 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8953   -0.4849   -1.0456 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0255    1.9619   -1.4499 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4077    1.2904   -1.6077 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8310    2.2405   -0.1152 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9670    0.6465    1.5325 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6013    1.3607   -0.0536 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7134   -0.3843    0.2838 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