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
   -0.5355    2.6087   -0.6282 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2890    1.3292   -1.1671 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5329    0.1588   -0.4855 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7583   -0.2796   -0.3550 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1101   -1.5318    0.3642 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5853   -0.5711    0.0794 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4734   -1.6494    0.7198 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9045   -0.1038   -0.0583 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0133   -0.7748    0.4699 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5966    2.7699   -0.3584 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1589    2.7854    0.2280 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2547    3.3528   -1.4038 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5747    0.3017   -0.7966 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7525   -1.4958    1.4075 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1804   -1.7505    0.2701 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5753   -2.3756   -0.1312 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2970   -1.6741   -0.1091 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8484   -1.0164    1.5360 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8790   -0.0836    0.4182 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