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
2.5905 -0.0900 0.4076 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5830 -1.0319 0.2353 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9101 -2.2451 0.1782 O 0 0 0 0 0 0 0 0 0 0 0 0
0.1757 -0.6318 0.1222 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1962 0.6294 0.1783 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5909 1.0165 0.0655 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9707 2.2151 0.1161 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.6055 0.0666 -0.1081 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5238 -0.3026 0.0877 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5689 -1.3864 -0.0095 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5427 1.3971 0.3104 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3935 0.3631 -0.6965 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