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
   -1.0998    2.3054    0.1686 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3855    0.9279    0.4093 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4990   -0.0580    0.0445 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9283   -1.0454   -0.7112 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3363   -1.1231   -1.1779 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8766    0.0111    0.4961 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2971    0.9373    1.2102 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8036   -0.9783    0.1410 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1505   -0.9270    0.5728 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9805    2.3918   -0.9424 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2177    2.6569    0.7209 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9835    2.8795    0.5098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2201   -1.8255   -0.9979 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3872   -1.5134   -2.2348 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8192   -0.1291   -1.2066 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9035   -1.7780   -0.5000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7714   -1.0581   -0.3624 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4381    0.0770    0.9565 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4232   -1.7508    1.2328 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