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
   -1.5006    2.2518    0.5439 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9233    1.5290   -0.5273 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6195    0.1908   -0.3366 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5850   -0.6742   -0.2303 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3211   -2.0937   -0.0288 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7634   -0.2309   -0.2576 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1175   -1.4236   -0.0863 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8078    0.7089   -0.3732 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1292    0.2257   -0.2867 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8159    2.2445    1.4163 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6974    3.2728    0.1654 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4362    1.7126    0.8360 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6064   -0.3466   -0.2908 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7858   -2.2635    0.9278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2531   -2.7061    0.0321 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7345   -2.5820   -0.8484 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7706    0.6301   -1.1007 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5139    0.4461    0.7148 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1765   -0.8915   -0.4097 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