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
   -1.0353    1.7046   -0.2984 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4173    0.5872    0.6433 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8876   -0.7228    0.2056 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7208   -1.7094   -0.0561 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5492   -0.8898    0.0743 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0409   -2.0045   -0.3004 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4644    0.1074    0.3348 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8458   -0.0507    0.2092 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0564    1.8508   -0.3643 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5028    2.6322    0.1000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4105    1.5521   -1.3185 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9793    0.8292    1.6294 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5132    0.5967    0.7319 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3465   -2.6766   -0.3783 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7943   -1.6277    0.0286 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1293   -1.0747    0.4532 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3182    0.6185    0.9841 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2034    0.2773   -0.7886 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