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
    3.8730    0.6743    0.0732 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9017   -0.3496    0.0632 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5634    0.0268    0.3322 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3401    1.2388    0.5589 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5092   -0.9509    0.3424 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8398   -2.2202    0.1158 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8951   -0.6742    0.6246 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7179   -0.0201   -0.4062 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1690    0.1593    0.1035 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2838    1.3535   -0.8224 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7559    0.3133    0.6399 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2074    0.8869   -0.9812 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4820    1.6095    0.5406 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8741   -2.4418   -0.0617 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1461   -3.0319    0.0987 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9939   -0.0564    1.5848 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4512   -1.6180    0.9448 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8460   -0.6098   -1.3387 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1924    0.7031    1.0500 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6233   -0.8221    0.2463 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7131    0.7183   -0.6801 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3810    1.2743   -1.4579 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0815    1.8303   -1.4744 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1443    2.0065    0.0596 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