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
    3.6550    0.7651   -0.5704 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6837   -0.2419   -0.6301 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4813   -0.0417    0.0521 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3740    1.0443    0.6712 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4180   -1.0231    0.0499 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6300   -2.1335   -0.6082 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8236   -0.8219    0.7702 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8074    0.1571    0.2856 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4351    1.5821    0.1731 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4767   -0.2607   -1.0250 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0524    0.9111    0.4698 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5224    0.5604   -1.2103 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1476    1.7344   -0.8343 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5500   -2.3002   -1.1185 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1295   -2.8859   -0.6358 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4047   -1.7969    0.9036 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6402   -0.5593    1.8697 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6699    0.1185    1.0307 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0599    2.0600    1.1014 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3846    2.1927   -0.0378 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7901    1.8452   -0.6815 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1025    0.6182   -1.3206 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7046   -0.3666   -1.8047 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0855   -1.1576   -0.8614 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