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
2.9095 -0.2687 0.3459 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4931 -0.0452 0.4201 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1568 0.5469 1.4583 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6508 -0.4977 -0.6443 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6258 -0.3995 -0.7732 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5444 0.2039 0.1427 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2107 0.7281 1.2179 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9317 0.2510 -0.1112 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5403 0.3531 0.8493 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1487 -1.0207 -1.5113 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1081 -0.8357 -1.7171 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4786 0.9844 0.3229 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