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
    3.7832   -0.2064   -1.4632 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3905   -0.0978   -1.2447 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9302   -0.2084    0.0601 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7866   -0.4005    0.9814 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5196   -0.1131    0.4057 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1699   -0.2285    1.6608 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4393    0.1038   -0.6699 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8762    0.1665   -0.2958 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4209   -1.0548    0.3501 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1689    1.4212    0.5291 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3549    0.0177   -0.5383 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0589    0.5778   -2.2091 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0804   -1.2197   -1.8004 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9215   -0.3926    2.4292 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8440   -0.1705    2.0218 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1865    1.1066   -1.1290 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2736   -0.6845   -1.4370 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4356    0.3193   -1.2625 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6136   -1.8067    0.4675 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1532   -1.5349   -0.3407 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9995   -0.8763    1.2777 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6726    2.1946   -0.0841 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1882    1.8861    0.8446 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7238    1.2010    1.4467 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