Monomers
N-Phenylmaleimide
Identifiers
IUPAC name
1-phenylpyrrole-2,5-dione
InchI
InChI=1S/C10H7NO2/c12-9-6-7-10(13)11(9)8-4-2-1-3-5-8/h1-7H
InchI Key
HIDBROSJWZYGSZ-UHFFFAOYSA-N
SMILES
O=C1C=CC(=O)N1c1ccccc1
Canonical SMILES
C1=CC=C(C=C1)N2C(=O)C=CC2=O
Isomeric SMILES
C1=CC=C(C=C1)N2C(=O)C=CC2=O
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C10H7NO2
Heavy Atom Count
13
Molecular Weight
173.171
Exact Molecular Weight
173.0477
Valence Electrons
64
Radical Electrons
0
tPSA
37.38
MolLogP
1.116
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
1
Aromatic Heterocycles
0
Aliphatic Rings
1
Aromatic Rings
1
MOL File
RDKit 3D
20 21 0 0 0 0 0 0 0 0999 V2000
1.4943 1.7081 1.4153 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8987 0.7253 0.7181 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2644 0.2959 0.5108 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2154 -0.7734 -0.2876 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8350 -1.0911 -0.6365 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4184 -2.0325 -1.3700 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0077 -0.1366 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.4117 -0.0099 -0.0217 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0090 1.1856 -0.3464 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3825 1.3591 -0.3879 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2171 0.3041 -0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6113 -0.8944 0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2387 -1.0727 0.2723 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1219 0.7871 0.9482 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1152 -1.3031 -0.6062 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3504 2.0228 -0.5794 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8346 2.3186 -0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3016 0.3941 -0.1161 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2325 -1.7648 0.4686 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7817 -2.0223 0.5294 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 8 1 0
8 9 2 0
9 10 1 0
10 11 2 0
11 12 1 0
12 13 2 0
7 2 1 0
13 8 1 0
3 14 1 0
4 15 1 0
9 16 1 0
10 17 1 0
11 18 1 0
12 19 1 0
13 20 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers