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
   -1.7349    1.7629   -0.5455 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2021    0.5833   -1.1533 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3115   -0.1735   -0.3809 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7048   -1.2799    0.2328 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0897   -1.7806    0.1437 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0564    0.3063   -0.2831 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3950    1.3491   -0.8713 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0322   -0.3563    0.4528 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3309    0.1456    0.5150 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8813    2.4242   -0.2961 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2216    1.3955    0.4033 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4798    2.2403   -1.1979 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0268   -1.8149    0.8098 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3405   -2.4466    0.9828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8084   -0.9206    0.1399 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2668   -2.3786   -0.7873 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1078   -0.6509    0.5045 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5629    0.8325   -0.3438 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5294    0.7622    1.4314 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