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
2.8406 -0.6561 0.5515 O 0 0 0 0 0 0 0 0 0 0 0 0
1.4912 -0.2131 0.6408 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1885 0.4889 1.6091 O 0 0 0 0 0 0 0 0 0 0 0 0
0.5888 -0.6172 -0.4013 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6535 -0.3066 -0.4722 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4863 0.4602 0.3591 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1244 1.0259 1.4122 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.8629 0.6709 0.0705 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5514 -0.2401 1.1691 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0311 -1.2747 -1.2366 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1693 -0.7358 -1.3796 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3952 1.3979 0.5318 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