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
   -1.9286   -2.0194   -0.1530 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9970   -1.4578    0.7178 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5231   -0.1659    0.4200 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4232    0.7736    0.2063 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0516    2.1696   -0.1152 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8995    0.1164    0.3520 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2711    1.2800    0.0839 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8729   -0.8413    0.5697 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2245   -0.4437    0.4754 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1829   -3.0381    0.2464 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8705   -1.4185   -0.2233 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5592   -2.1437   -1.1968 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4714    0.5211    0.2666 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5166    2.6136    0.7364 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4932    2.2365   -1.0880 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9958    2.7750   -0.2436 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5584   -0.2986   -0.5704 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8250   -1.2153    1.0016 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3618    0.5565    0.9724 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