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
   -1.2858    1.8348    0.0283 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0070    0.6223    0.6877 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3182   -0.4316    0.1737 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9718   -1.5222   -0.1673 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4462   -1.5496    0.0276 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1255   -0.4181   -0.0224 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7363   -1.4059   -0.4993 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8916    0.7103    0.3180 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2846    0.6990    0.1191 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8659    2.4626    0.7477 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3634    2.3545   -0.3118 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9704    1.6169   -0.8380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4472   -2.3923   -0.5855 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7269   -2.1191    0.9363 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8319   -0.5132    0.0202 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8682   -2.0287   -0.8994 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8140    0.7256    1.0957 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6279   -0.2300   -0.3869 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6231    1.5845   -0.4433 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