Monomers

2-Ethylacrylic acid

Identifiers

IUPAC name
2-methylidenebutanoic acid
InchI
InChI=1S/C5H8O2/c1-3-4(2)5(6)7/h2-3H2,1H3,(H,6,7)
InchI Key
WROUWQQRXUBECT-UHFFFAOYSA-N
SMILES
CCC(=C)C(=O)O
Canonical SMILES
CCC(=C)C(=O)O
Isomeric SMILES
CCC(=C)C(=O)O
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C5H8O2
Heavy Atom Count
7
Molecular Weight
100.117
Exact Molecular Weight
100.0524
Valence Electrons
40
Radical Electrons
0
tPSA
37.3
MolLogP
1.0372
H Bond Acceptors
1
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 15 14  0  0  0  0  0  0  0  0999 V2000
   -1.6928   -1.0270   -0.3042 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0417    0.1197    0.3729 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3159    0.4471   -0.0013 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5046    1.6612   -0.4985 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4761   -0.4194    0.1155 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4310   -1.5889    0.5693 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7405   -0.0010   -0.2761 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4130   -0.6531   -1.0908 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0490   -1.7433   -0.7898 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3323   -1.5638    0.4278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0322   -0.0620    1.4925 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6935    1.0052    0.2618 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4895    1.9870   -0.8036 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2762    2.4005   -0.6365 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5732   -0.5623   -0.1879 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
  1  8  1  0
  1  9  1  0
  1 10  1  0
  2 11  1  0
  2 12  1  0
  4 13  1  0
  4 14  1  0
  7 15  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers