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
-1.6281 0.2324 1.2451 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4976 -0.8163 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5125 -1.6101 0.3399 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3667 -1.0560 -0.4788 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7327 -0.3838 -0.5993 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1622 0.8203 0.0784 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5075 1.4296 0.9274 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4382 1.3530 -0.2520 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5483 0.6196 1.4140 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4698 -1.9677 -1.1208 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4485 -0.8127 -1.3448 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7338 2.1916 0.2167 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