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
   -1.7331    1.9499   -0.1592 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3322    0.7523   -0.7425 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3683   -0.1034   -0.2581 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7326   -1.2041    0.3431 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1648   -1.5397    0.5084 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0302    0.2182   -0.4160 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3443    1.2838   -0.9986 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0638   -0.5866    0.0413 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4327   -0.2598   -0.1199 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8712    2.6542   -0.0829 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2409    1.8398    0.8190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4568    2.4404   -0.8626 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0277   -1.8657    0.7179 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2498   -2.6500    0.3679 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7294   -0.9841   -0.2561 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4422   -1.2507    1.5505 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5912    0.7070   -0.6132 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9353   -1.0679   -0.7257 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8962   -0.3338    0.8867 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