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
   -1.7825    0.1715   -0.1091 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6029   -0.3481    0.7041 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6344   -0.4279   -0.0937 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2347   -1.5792   -0.2538 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2040    0.7568   -0.7097 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2477    0.7276   -1.3903 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5863    2.0043   -0.5577 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4536    0.8698   -0.8900 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3228   -0.7136   -0.5492 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4704    0.6877    0.6004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4336    0.3994    1.5309 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8643   -1.2866    1.2027 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8478   -2.4627    0.1809 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1357   -1.6364   -0.8349 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0396    2.8375   -0.9450 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