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
   -0.7331    2.8126    0.1162 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1577    1.6948    0.8655 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7749    0.4336    0.3560 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6916   -0.2817   -0.2609 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3112   -1.6032   -0.8007 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6019   -0.0026    0.5397 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3800    0.7889    1.1540 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0942   -1.2145    0.0860 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4647   -1.5143    0.3350 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0696    3.7598    0.5757 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3679    2.8765    0.0283 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1659    2.6951   -0.9199 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6956    0.1069   -0.3602 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9898   -2.2355    0.0573 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5014   -1.5540   -1.5634 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2204   -2.0458   -1.2773 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7012   -2.4218   -0.2429 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6603   -1.6290    1.4219 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0408   -0.6658   -0.1101 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