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
-2.4572 0.8078 0.0583 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8854 -0.4605 -0.0424 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6859 -1.4137 -0.2150 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4510 -0.6825 0.0451 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4150 0.3003 0.2263 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8485 0.0689 0.3126 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2712 -1.1114 0.2103 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7691 1.0765 0.5009 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4592 0.9005 0.2879 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0734 -1.6723 -0.0389 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0747 1.3139 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6335 0.8725 1.0070 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