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
   -1.3477    2.1853   -0.2285 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4367    0.9085    0.3576 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4487   -0.0375    0.0812 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8493   -1.1959   -0.4176 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2617   -1.5089   -0.6821 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9402    0.2452    0.3314 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3306    1.3223    0.7969 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8928   -0.7250    0.0420 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2711   -0.5093    0.2647 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3571    2.1427   -1.3497 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2156    2.8042    0.1410 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4458    2.7021    0.1607 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0883   -1.9452   -0.6386 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8397   -1.7556    0.2403 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7503   -0.6705   -1.1921 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3392   -2.3957   -1.3369 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6449    0.4169   -0.1749 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4985   -0.6354    1.3362 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8019   -1.3483   -0.2742 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