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
   -0.7488    2.4750   -0.0446 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2884    1.1835   -0.0105 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5500    0.0306    0.0534 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1255   -1.1419    0.0551 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5884   -1.3517   -0.0095 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9010    0.1338    0.1201 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5075    1.2352    0.1216 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6673   -1.0194    0.1854 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0719   -0.9193    0.2500 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1354    2.7394    0.8275 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0945    2.5552   -0.9518 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5703    3.2189   -0.1410 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5191   -2.0580    0.1069 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7731   -2.0503   -0.8622 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8860   -1.9026    0.9055 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1408   -0.4031   -0.1072 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4188   -1.7898    0.8664 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4031    0.0515    0.6740 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4509   -0.9867   -0.7871 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