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
1.5592 2.2065 0.5562 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8677 1.1103 0.0218 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2078 0.7156 -0.3816 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1770 -0.4951 -0.9081 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7973 -0.9956 -0.8912 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4116 -2.1125 -1.3156 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9897 0.0194 -0.3068 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.4073 -0.0209 -0.0848 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1211 1.1640 -0.0919 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4942 1.1061 0.1279 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1518 -0.0806 0.3490 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4366 -1.2614 0.3555 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0664 -1.2212 0.1378 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1072 1.2963 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9934 -1.0961 -1.3122 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6900 2.1250 -0.2552 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0630 2.0469 0.1226 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2260 -0.1428 0.5228 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9493 -2.2031 0.5295 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5052 -2.1608 0.1441 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