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
0.9108 1.4128 -0.7848 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2944 0.0810 -0.8429 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3796 -0.0745 -1.5178 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6425 -1.0475 -0.2647 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4352 -1.1292 0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2951 -0.0401 0.8372 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3452 -0.2964 1.5478 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1503 1.2966 0.5552 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5644 2.1400 -0.4714 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1489 -2.0285 -0.4512 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7663 -2.1323 0.7934 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9484 1.8180 0.1602 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