Monomers

Methyl 2-ethylacrylate

Identifiers

IUPAC name
methyl 2-methylidenebutanoate
InchI
InChI=1S/C6H10O2/c1-4-5(2)6(7)8-3/h2,4H2,1,3H3
InchI Key
JKJJSJJGBZXUQV-UHFFFAOYSA-N
SMILES
CCC(=C)C(=O)OC
Canonical SMILES
CCC(=C)C(=O)OC
Isomeric SMILES
CCC(=C)C(=O)OC
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C6H10O2
Heavy Atom Count
8
Molecular Weight
114.144
Exact Molecular Weight
114.0681
Valence Electrons
46
Radical Electrons
0
tPSA
26.3
MolLogP
1.1256
H Bond Acceptors
2
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

 18 17  0  0  0  0  0  0  0  0999 V2000
   -2.0712   -1.3156   -0.0036 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8399    0.1754    0.1080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5272    0.5885   -0.3930 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4794    1.4628   -1.4135 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7233    0.1147    0.1418 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6911   -0.7022    1.0952 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9668    0.5026   -0.3285 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1327   -0.0187    0.2628 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5938   -1.8640    0.8090 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7714   -1.6630   -1.0143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1674   -1.4773    0.0737 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6574    0.6820   -0.4258 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8555    0.4026    1.2109 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4432    1.8083   -1.8299 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3883    1.8585   -1.8619 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3135    0.4636    1.2490 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0550   -1.1155    0.4502 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0259    0.0973   -0.4024 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
  3  5  1  0
  5  6  2  0
  5  7  1  0
  7  8  1  0
  1  9  1  0
  1 10  1  0
  1 11  1  0
  2 12  1  0
  2 13  1  0
  4 14  1  0
  4 15  1  0
  8 16  1  0
  8 17  1  0
  8 18  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers