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
2.2774 0.9482 0.0247 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8999 -0.3955 -0.1349 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8019 -1.2447 -0.0846 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5023 -0.7248 -0.3469 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4198 0.2105 -0.3928 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8275 -0.0597 -0.6014 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1991 -1.2419 -0.7470 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7329 0.9759 -0.6369 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2711 1.2056 0.0792 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2169 -1.7572 -0.4689 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0863 1.2539 -0.2635 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7039 0.8298 -0.3698 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