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
   -1.8553   -1.8078    0.1221 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3577   -0.7833   -0.7154 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3407    0.0817   -0.2900 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5860    1.3408   -0.0076 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9283    1.9596   -0.1074 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9928   -0.4782   -0.1765 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2482   -1.6751   -0.4406 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0219    0.3409    0.2392 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3420   -0.1250    0.3748 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6520   -2.3316   -0.4787 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1059   -2.5837    0.3519 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3086   -1.3790    1.0497 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2264    1.9669    0.3152 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1394    2.1802   -1.1880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6549    1.1945    0.2640 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9873    2.8692    0.5244 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9100   -0.0938   -0.5856 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3466   -1.1743    0.7518 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8282    0.4982    1.1628 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