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
   -1.5606   -1.9055    0.5332 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6149   -0.5023    0.5355 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4789    0.2032    0.1524 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5189    1.5489    0.0844 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8066    2.1873    0.4331 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7630   -0.4359   -0.1825 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8762   -1.6778   -0.1426 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8557    0.3060   -0.5547 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0701   -0.3428   -0.8808 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3297   -2.2402   -0.5100 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5660   -2.3162    0.7994 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8413   -2.3144    1.2445 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3542    2.0908   -0.2099 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8817    3.2277    0.0575 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8924    2.1812    1.5587 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6150    1.5377    0.0607 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6920    0.3603   -1.4832 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.2419   -1.4907 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6368   -0.6661   -0.0050 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