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
   -0.7687    1.9110   -0.3971 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8292    1.0256    0.7128 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4114   -0.2847    0.5143 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2122   -1.3206    0.6466 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6455   -1.1918    1.0221 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9712   -0.4995    0.1456 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3698   -1.6738   -0.0385 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8758    0.5303   -0.0136 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1919    0.2446   -0.3702 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1236    2.9262   -0.1303 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4556    1.4998   -1.1870 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2509    2.0187   -0.8035 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8482   -2.3137    0.4840 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2259   -2.0721    0.6965 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7527   -1.0843    2.1245 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0890   -0.3036    0.5282 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2484   -0.2641   -1.3532 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7428    1.2147   -0.4267 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7110   -0.3628    0.4077 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