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
    2.8312    0.0803   -0.1955 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5711   -0.7205    0.0083 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3703    0.1267   -0.0490 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4834    1.4261   -0.2590 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9681   -0.4412    0.1232 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1427   -1.6762    0.3270 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1162    0.3365    0.0735 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4135   -0.2097    0.2398 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6942   -0.6319   -0.1744 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7900    0.6056   -1.1698 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9755    0.7765    0.6424 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6129   -1.2200    1.0029 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5415   -1.5082   -0.7755 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3928    2.0711   -0.3051 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4308    1.9149   -0.3945 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3758   -1.2235    0.6846 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0018    0.5032    0.8591 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8899   -0.2095   -0.7662 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