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
-1.1659 1.3201 0.3835 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3111 0.0384 0.8616 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3260 -0.1634 1.6104 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4162 -1.0566 0.5783 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6632 -1.0478 -0.1571 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2754 0.0137 -0.8871 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3543 -0.2528 -1.5407 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8808 1.3264 -1.0079 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0247 1.8385 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7018 -2.0244 1.0588 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1772 -2.0528 -0.2085 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5949 2.0608 -0.8804 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