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
   -1.3529    1.5806    0.8112 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8120    0.3140    1.0561 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2457   -0.4792    0.0645 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9629   -1.4052   -0.5431 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3732   -1.6852   -0.2505 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1496   -0.2599   -0.2806 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6586   -0.9764   -1.1753 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9325    0.6968    0.3305 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2949    0.9092   -0.0082 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1910    1.5333    0.0785 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6095    2.3058    0.3926 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7177    2.0138    1.7442 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4884   -2.0129   -1.3190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9251   -0.8079    0.1672 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9035   -1.9742   -1.2051 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4791   -2.5841    0.4034 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7996   -0.0712   -0.2377 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4347    1.5408   -0.8818 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7911    1.3619    0.8531 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