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
   -1.7411   -1.8823   -0.4788 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6025   -0.5367   -0.8726 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7867    0.3750   -0.2263 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3109    1.4588    0.2678 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4619    2.4492    0.9630 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6397    0.1290   -0.0985 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4299    0.9069    0.4701 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1831   -1.0516   -0.6418 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5739   -1.2380   -0.4880 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1348   -1.8760    0.5768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5172   -2.3337   -1.1332 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8123   -2.4671   -0.5572 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3893    1.5997    0.1467 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2647    2.8992    0.2735 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0067    2.0449    1.9004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1447    3.2981    1.2664 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7918   -1.4459    0.5911 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9540   -2.0358   -1.1403 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0577   -0.2936   -0.8193 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