Monomers

Maleic acid

Identifiers

IUPAC name
(Z)-but-2-enedioic acid
InchI
InChI=1S/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/b2-1-
InchI Key
VZCYOOQTPOCHFL-UPHRSURJSA-N
SMILES
OC(=O)/C=C\C(=O)O
Canonical SMILES
C(=CC(=O)O)C(=O)O
Isomeric SMILES
C(=C\C(=O)O)\C(=O)O
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C4H4O4
Heavy Atom Count
8
Molecular Weight
116.072
Exact Molecular Weight
116.011
Valence Electrons
44
Radical Electrons
0
tPSA
74.6
MolLogP
-0.2882
H Bond Acceptors
2
H Bond Donors
2
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 12 11  0  0  0  0  0  0  0  0999 V2000
    2.7904   -0.1242    0.0265 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3694    0.0057    0.1684 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0549    0.5171    1.2816 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4966   -0.4174   -0.8710 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7765   -0.3835   -0.9303 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6684    0.1095    0.0781 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9592    0.0821   -0.1203 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3582    0.6452    1.3097 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3778    0.4675    0.5958 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0111   -0.8444   -1.7694 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3160   -0.7680   -1.8480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0220    0.7107    2.0790 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  0
  2  4  1  0
  4  5  2  3
  5  6  1  0
  6  7  2  0
  6  8  1  0
  1  9  1  0
  4 10  1  0
  5 11  1  0
  8 12  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers