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
-1.7693 -2.1481 -0.3781 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.0275 -0.9195 -0.2539 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3230 -0.2851 -0.3106 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1793 1.0285 -0.1308 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7895 1.2964 0.0482 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2552 2.4566 0.2547 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0084 0.0900 -0.0217 N 0 0 0 0 0 0 0 0 0 0 0 0
0.4003 -0.0512 0.0747 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0107 -1.3053 0.1161 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3956 -1.4387 0.1581 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2263 -0.3495 0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6344 0.8842 0.1265 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2688 1.0169 0.0834 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2891 -0.7633 -0.4758 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9927 1.7622 -0.1326 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3741 -2.1695 0.1253 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8243 -2.4159 0.1866 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3151 -0.4569 0.1856 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3004 1.7566 0.1257 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8839 2.0116 0.0553 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