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
   -2.0064    1.3516    0.0214 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8127   -0.0833    0.5238 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5612   -0.6653   -0.0465 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6247   -1.7419   -0.7870 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7322   -0.0528    0.2084 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7743    0.9788    0.9204 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.9131   -0.5541   -0.2965 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1423    0.0973   -0.0061 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0241    1.5014   -0.3904 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2951    1.5539   -0.8057 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8308    2.0041    0.8943 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8172   -0.1256    1.6342 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6814   -0.6537    0.1803 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5698   -2.1986   -0.9796 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2623   -2.1660   -1.1993 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7800   -0.6083    0.5684 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6624    0.4028   -0.9248 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9569    0.9596    0.6718 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