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
2.3262 -0.6198 -1.4386 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1721 -0.1712 -0.7705 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8537 0.9949 -1.0049 O 0 0 0 0 0 0 0 0 0 0 0 0
0.4274 -1.0157 0.1163 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6343 -0.6928 0.7672 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3995 0.5191 0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4585 0.5788 1.5977 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1544 1.7009 0.1882 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0149 0.0459 -1.7093 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8089 -2.0601 0.2551 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0527 -1.5174 1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9037 2.2374 -0.2502 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