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
    3.8800   -0.9357   -0.1322 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8808    0.0707   -0.1300 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5722   -0.1552    0.2178 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2282   -1.3091    0.5538 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5993    0.8986    0.2035 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0663    2.1149   -0.1639 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8076    0.8194    0.5468 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7226    0.0199   -0.2677 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1154    0.1751    0.3811 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5021   -1.4337   -0.4177 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6470   -1.6407   -0.9457 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8398   -1.4110    0.8726 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8632   -0.4411   -0.3211 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0939    2.2944   -0.4297 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4260    2.9893   -0.2127 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2262    1.8650    0.5988 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8925    0.4872    1.6347 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7923    0.4867   -1.2926 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1733    1.1225    0.9561 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3003   -0.6450    1.1051 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9021    0.1812   -0.4008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7810   -1.7328   -1.2136 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4830   -1.8488   -0.8305 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3983   -1.9719    0.5320 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