Monomers
Maleimide
Identifiers
IUPAC name
pyrrole-2,5-dione
InchI
InChI=1S/C4H3NO2/c6-3-1-2-4(7)5-3/h1-2H,(H,5,6,7)
InchI Key
PEEHTFAAVSWFBL-UHFFFAOYSA-N
SMILES
O=C1C=CC(=O)N1
Canonical SMILES
C1=CC(=O)NC1=O
Isomeric SMILES
C1=CC(=O)NC1=O
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C4H3NO2
Heavy Atom Count
7
Molecular Weight
97.073
Exact Molecular Weight
97.0164
Valence Electrons
36
Radical Electrons
0
tPSA
46.17
MolLogP
-0.801
H Bond Acceptors
2
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
1
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
0
MOL File
RDKit 3D
10 10 0 0 0 0 0 0 0 0999 V2000
-2.2792 0.8149 -0.0355 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1092 0.4054 0.1869 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7145 -0.9740 0.4588 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5964 -1.0039 0.6399 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1303 0.3605 0.4953 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3527 0.6615 0.6120 O 0 0 0 0 0 0 0 0 0 0 0 0
0.0458 1.2346 0.2107 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.3353 -1.8650 0.5166 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1767 -1.8996 0.8601 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1362 2.2655 0.0593 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0
2 3 1 0
3 4 2 0
4 5 1 0
5 6 2 0
5 7 1 0
7 2 1 0
3 8 1 0
4 9 1 0
7 10 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers