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
   -2.4221   -1.1339    0.1423 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9378   -0.9665    0.0346 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5177    0.4576    0.0749 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3512    1.4518    0.1914 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9025    0.7345   -0.0224 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3058    1.9379    0.0079 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8463   -0.2776   -0.1485 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2207    0.0862   -0.2377 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6503   -2.2075    0.0319 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9590   -0.5116   -0.5994 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7586   -0.8437    1.1616 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4819   -1.4441    0.9461 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5730   -1.4696   -0.8970 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3994    1.2533    0.2634 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9993    2.4569    0.2155 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3942    1.0949    0.2164 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5926    0.0609   -1.2750 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7882   -0.6795    0.3293 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