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
-2.7113 0.5987 -0.6735 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3105 0.5266 -0.4833 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6402 0.8938 -1.4598 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7568 0.0604 0.7541 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4961 -0.0519 1.0530 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6712 0.2402 0.2783 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8026 0.0246 0.8510 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7691 0.7214 -0.9986 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0407 1.2920 -1.3218 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4826 -0.2404 1.5501 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6764 -0.4464 2.1002 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5268 0.5143 -1.6497 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