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
   -0.6242    2.0756   -0.2578 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6844    0.9764    0.5945 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4098   -0.3240    0.2757 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3679   -1.2319    0.2311 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7898   -0.9188    0.5177 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9523   -0.7169   -0.0186 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2936   -1.8924   -0.3212 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9523    0.2387    0.0296 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2953   -0.1158   -0.2536 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9132    2.9830    0.3381 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3493    2.2858   -0.6952 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3635    2.0422   -1.0949 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0851   -2.2420   -0.0274 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3819   -1.2694   -0.3530 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9619    0.1662    0.6023 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1738   -1.4431    1.4047 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8160    0.7815   -0.6471 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3389   -0.9245   -1.0306 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7578   -0.4707    0.7056 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