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
   -1.7373   -0.8659    0.6895 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4978    0.5911    0.3513 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4531    0.7483   -0.7025 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7357    1.3317   -1.8418 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9091    0.2373   -0.4474 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7866    0.3723   -1.3395 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2265   -0.3832    0.7531 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5748   -0.8433    0.9017 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9798   -0.9332    1.7823 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6217   -1.2636    0.1526 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8446   -1.4568    0.4252 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4422    1.0054   -0.0118 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2143    1.1783    1.2588 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0226    1.4386   -2.5904 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7247    1.7005   -2.0221 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7969   -1.1192    1.9372 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7146   -1.7071    0.2041 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2201   -0.0313    0.4998 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