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
   -0.9085    1.5153   -1.3764 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8356    0.1364   -1.0802 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4090   -0.3808    0.1127 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2431   -0.8011    1.0352 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7185   -0.7574    0.8774 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0264   -0.4631    0.3566 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5005   -0.9319    1.4413 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9666   -0.0379   -0.5730 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3718   -0.1309   -0.3057 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2851    1.6521   -2.4066 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5696    2.0744   -0.6856 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0830    2.0151   -1.3395 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8786   -1.2070    1.9725 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0441   -0.5946   -0.1560 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1206   -1.7213    1.2692 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1270    0.0299    1.5503 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9272   -0.3547   -1.2407 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7068    0.8631    0.0682 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5574   -0.9054    0.4802 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