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
   -1.2560   -2.4872   -0.1873 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6607   -1.5097    0.6382 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5763   -0.1911    0.2435 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6492    0.5180    0.0516 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5736    1.9288   -0.3704 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7352    0.3897    0.0463 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9437    1.5794   -0.3123 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9008   -0.3704    0.2517 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1815    0.1941    0.0600 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3183   -2.2128   -0.3846 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2509   -3.4639    0.3684 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6985   -2.6213   -1.1414 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6095    0.0637    0.2046 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0778    2.0761   -1.3524 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0456    2.5848    0.3555 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6136    2.3711   -0.4193 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8194   -0.4296   -0.6157 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0612    1.1684   -0.4555 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6883    0.4119    1.0244 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