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
   -1.4369    2.6703    0.1821 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2446    1.4984    0.9311 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7181    0.3411    0.4233 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5022   -0.6458    0.0791 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0229   -1.9310   -0.4771 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7119    0.2292    0.2746 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4948    1.1793    0.6040 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3325   -0.9203   -0.2371 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7186   -0.9712   -0.3579 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8766    3.4413    0.8500 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1185    2.4208   -0.6539 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4343    3.0030   -0.1796 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5898   -0.5292    0.2045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3822   -2.4017    0.3229 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4727   -1.8112   -1.4215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8738   -2.6219   -0.5991 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0614   -1.0617   -1.4092 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1588   -1.8605    0.1696 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1947   -0.0288    0.0301 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