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
   -1.5306   -1.3865    0.1043 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6442    0.0950   -0.1146 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5462    0.8396    0.5588 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8827    1.7261    1.4709 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8497    0.6243    0.2491 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7268    1.2801    0.8481 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2247   -0.3013   -0.7048 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5754   -0.5492   -1.0442 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3012   -1.8868   -0.5175 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6540   -1.6819    1.1574 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5462   -1.7702   -0.2378 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6241    0.4550    0.2085 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4872    0.2620   -1.2202 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8992    1.9319    1.7456 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1162    2.2863    1.9816 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2122    0.3560   -0.9441 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9579   -1.3508   -0.3651 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6851   -0.9298   -2.0781 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