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
   -2.0313   -1.5807   -0.1613 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5757   -0.4617    0.5330 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3841    0.2003    0.2587 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3610    1.4971    0.0245 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5981    2.3174    0.0406 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8367   -0.5831    0.2381 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8481   -1.8194    0.4570 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0543    0.0280   -0.0306 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2503   -0.7424   -0.0502 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3458   -2.4519   -0.1141 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3023   -1.3733   -1.2137 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9734   -1.9199    0.3415 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5979    1.9458   -0.1814 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9985    2.4404   -0.9961 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3821    3.3703    0.3832 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4010    1.8595    0.6403 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7665   -0.5462   -1.0148 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9365   -0.3608    0.7576 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0630   -1.8194    0.0877 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