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
-1.5145 0.5817 1.1987 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5678 -0.5332 0.3924 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7030 -1.1416 0.4436 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5331 -1.0617 -0.4607 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6601 -0.5760 -0.6291 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2834 0.5871 -0.0401 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7471 1.3596 0.7732 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6239 0.9219 -0.3863 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3638 1.1208 1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8085 -1.9869 -1.0271 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2830 -1.1816 -1.3566 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8931 1.9099 -0.3280 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