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
   -1.6783    1.3991   -0.2098 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2584    0.1503   -0.7349 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2307   -0.5292   -0.1075 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5106   -1.6500    0.5112 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8835   -2.1897    0.5481 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1384   -0.0496   -0.1088 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0355   -0.7068    0.4777 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5237    1.1279   -0.7395 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8750    1.5341   -0.7002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4912    1.8483   -0.7770 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8068    2.0972   -0.1360 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0336    1.2663    0.8389 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2582   -2.2148    1.0148 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2285   -2.1619    1.6088 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8175   -3.2473    0.1665 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5406   -1.5753   -0.1057 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4936    0.6401   -0.5003 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9659    2.2206    0.1935 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1893    2.0407   -1.6350 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