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
    3.0067    1.5642   -0.6595 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8655    0.7437   -0.5211 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6872   -0.1452    0.5155 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6367   -0.1910    1.3725 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5612   -1.0261    0.7385 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6666   -1.8202    1.8242 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6218   -1.1650   -0.1131 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6126   -0.0852    0.0632 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8211   -0.3430   -0.8733 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0790    1.2726   -0.2666 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5906    1.2186   -1.5503 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7121    1.4345    0.2079 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7593    2.6439   -0.7111 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5169   -1.7934    2.4619 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1401   -2.4831    2.0246 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3119   -1.2909   -1.1826 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1122   -2.1587    0.1204 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0473   -0.0696    1.1107 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8769   -1.4384   -1.0942 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7412    0.0511   -0.4281 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6165    0.1983   -1.8081 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0040    1.9564   -0.2892 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6176    1.2920   -1.2518 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4008    1.6346    0.5166 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