Monomers

Methyl 2-methoxybut-2-enoate

Identifiers

IUPAC name
methyl (Z)-2-methoxybut-2-enoate
InchI
InChI=1S/C6H10O3/c1-4-5(8-2)6(7)9-3/h4H,1-3H3/b5-4-
InchI Key
XDAOZDBTFSSMBW-PLNGDYQASA-N
SMILES
CO/C(=C\C)/C(=O)OC
Canonical SMILES
CC=C(C(=O)OC)OC
Isomeric SMILES
C/C=C(/C(=O)OC)\OC
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C6H10O3
Heavy Atom Count
9
Molecular Weight
130.143
Exact Molecular Weight
130.063
Valence Electrons
52
Radical Electrons
0
tPSA
35.53
MolLogP
0.7096
H Bond Acceptors
3
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

 19 18  0  0  0  0  0  0  0  0999 V2000
   -2.0163    2.2675   -0.2698 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6127    1.3376    0.7052 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7786    0.2725    0.4736 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2778   -0.9422    0.5681 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4649   -2.1674    0.3380 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6464    0.4626    0.1260 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1060    1.6288    0.0401 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5098   -0.5910   -0.1124 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8685   -0.3620   -0.4428 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1959    2.8135   -0.7329 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7447    2.9763    0.1677 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5658    1.7017   -1.0570 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3188   -1.0572    0.8227 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0445   -2.2335   -0.6697 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1033   -3.0686    0.4654 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3395   -2.2035    1.0949 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2776    0.3673    0.3041 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9088    0.0688   -1.4737 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4668   -1.2716   -0.3474 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  3
  4  5  1  0
  3  6  1  0
  6  7  2  0
  6  8  1  0
  8  9  1  0
  1 10  1  0
  1 11  1  0
  1 12  1  0
  4 13  1  0
  5 14  1  0
  5 15  1  0
  5 16  1  0
  9 17  1  0
  9 18  1  0
  9 19  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers