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
   -0.3865    2.8526   -0.1015 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2998    1.8201    0.1529 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8884    0.5029    0.1343 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8120   -0.4211    0.2972 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4266   -1.8419    0.2857 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5038    0.1468   -0.0566 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3774    1.0763   -0.2123 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9776   -1.1614   -0.0845 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3599   -1.3916   -0.2779 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0487    2.7318   -1.1115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9927    3.7915   -0.1534 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3597    2.9169    0.7127 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8429   -0.0965    0.4367 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0189   -2.0888   -0.7161 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7507   -2.0631    1.1139 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3630   -2.4259    0.4701 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6856   -2.2586    0.3592 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5744   -1.5802   -1.3601 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8943   -0.5099    0.1112 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