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
   -2.2291   -1.2944   -0.1169 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6703   -0.0483   -0.3859 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3605    0.3205   -0.1480 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1298    1.5782    0.1697 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2094    2.5945    0.2788 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7133   -0.6523   -0.2477 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4785   -1.8508   -0.5522 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0433   -0.3272   -0.0176 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0952   -1.2697   -0.1129 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1863   -1.5849    0.9529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8354   -2.0667   -0.7944 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3305   -1.2126   -0.3469 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9068    1.8553    0.3545 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1657    2.0208    0.3457 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1815    3.2067   -0.6392 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1199    3.2221    1.1688 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4709   -1.5691    0.8851 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9111   -0.7525   -0.6984 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7993   -2.1696   -0.6940 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