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
    3.8350    0.9343    0.4204 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4655    0.6205    0.1749 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9525   -0.6488    0.2890 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7417   -1.5685    0.6273 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5407   -0.8792    0.0192 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0867   -2.0947    0.1365 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2931    0.2851   -0.3647 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7378   -0.0103   -0.5610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3925    1.3201   -0.9632 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3312   -0.4042    0.7793 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2957    1.0861   -0.5882 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3449    0.1797    1.0256 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8272    1.9502    0.8971 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7329   -2.8974    0.4230 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9469   -2.3029   -0.0604 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2015    1.1346    0.3404 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1139    0.6594   -1.3454 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9488   -0.7666   -1.3304 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4723    1.1623   -1.1670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2940    1.9767   -0.0639 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8809    1.7565   -1.8329 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5330   -0.6417    1.5325 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9937   -1.3113    0.6583 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9111    0.4599    1.1564 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