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
   -1.8876   -1.7035   -0.1248 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2538   -0.7978    0.7887 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2935    0.0330    0.2602 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6620    1.1948   -0.2190 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0760    1.6413   -0.2100 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0979   -0.3742    0.2365 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4736   -1.5009    0.6984 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1051    0.4247   -0.2844 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4408   -0.0358   -0.2751 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3659   -1.0541   -0.8895 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1440   -2.3825   -0.5977 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6086   -2.3334    0.4089 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0548    1.9079   -0.6563 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6600    1.1342    0.5832 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4904    1.4141   -1.2271 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1116    2.7322   -0.0364 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5537   -1.0411    0.1503 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8184    0.0449   -1.3161 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0094    0.6965    0.3680 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