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
   -2.3474   -1.9481    0.0248 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0496   -0.6986    0.5942 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9148    0.0468    0.2675 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0665    1.3042   -0.0545 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0265    2.2369   -0.4269 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4086   -0.5256    0.2751 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6381   -1.7308    0.5745 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4861    0.2626   -0.0568 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7856   -0.2603   -0.0599 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4605   -1.8922   -1.0744 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2499   -2.3374    0.5135 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5001   -2.6274    0.2736 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0907    1.7053   -0.0491 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7308    2.4030    0.3973 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4102    3.2577   -0.6400 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5355    1.9318   -1.3492 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4714    0.5432    0.2729 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9093   -1.0932    0.6598 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0980   -0.5778   -1.0586 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