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
   -2.6251   -0.4618   -0.1668 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1532   -0.7221   -0.0073 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3850    0.5360   -0.0453 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0306    1.6698   -0.2040 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0762    0.5225    0.0919 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7256    1.5919    0.0593 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7864   -0.6517    0.2602 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1989   -0.6621    0.3925 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0553    0.1244    0.6605 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1538   -1.4580   -0.1301 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8374   -0.0516   -1.1604 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8392   -1.3076   -0.9201 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9244   -1.3540    0.8641 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4546    2.5830   -0.2298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1012    1.6488   -0.3019 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6869    0.1350   -0.1927 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5849   -1.6459    0.0903 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5010   -0.4965    1.4555 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