Back to Search
Molecule
N-(4-Hydroxyphenyl)Maleimide
CAS: 7300-91-6 · C10H7NO3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 7300-91-6
- Molecular Formula
- C10H7NO3
- Molecular Mass
- 189.17 g/mol
Identifiers
CAS Registry Number
7300-91-6
SMILES
O=C1C=CC(=O)N1c1ccc(O)cc1
InChI Key
BLLFPKZTBLMEFG-UHFFFAOYSA-N
InChI
InChI=1S/C10H7NO3/c12-8-3-1-7(2-4-8)11-9(13)5-6-10(11)14/h1-6,12H
Names and Synonyms
- N-(4-Hydroxyphenyl)Maleimide Synonym
- 1H-Pyrrole-2,5-dione, 1-(4-hydroxyphenyl)- Synonym
- Maleimide, N-(p-hydroxyphenyl)- Synonym
- 1-(4-Hydroxyphenyl)-1H-pyrrole-2,5-dione Synonym
- N-(4-Hydroxyphenyl)maleimide Synonym
- N-(p-Hydroxyphenyl)maleimide Synonym
- p-Maleimidophenol Synonym
- 4-Maleimidophenol Synonym
- NSC 148152 Synonym
- NSC 39735 Synonym
- 1-(4-Hydroxy-phenyl)pyrrole-2,5-dione Synonym
- 1-(4-Hydroxyphenyl)-2,5-dihydro-1H-pyrrole-2,5-dione Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 189.17 g/mol | CAS Common Chemistry |
| 189.17000000000002 g/mol | RDKit | |
| Canonical SMILES | O=C1C=CC(=O)N1C2=CC=C(O)C=C2 | CAS Common Chemistry |
| InChI | InChI=1S/C10H7NO3/c12-8-3-1-7(2-4-8)11-9(13)5-6-10(11)14/h1-6,12H | CAS Common Chemistry |
| InChI Key | InChIKey=BLLFPKZTBLMEFG-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 154-155 °C | CAS Common Chemistry |
| Name | N-(4-Hydroxyphenyl)maleimide | CAS Common Chemistry |
| Heavy Atom Count | 14 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 57.61 Ų | RDKit |
| 57.38 Ų | chempirical lib | |
| LogP | 0.8215999999999999 | RDKit |
| 0.8216 | RDKit | |
| Molar Refractivity | 49.73980000000002 cm³/mol | RDKit |
| Ring Count | 2 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 189.042593084 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
Convert
Quick conversion
MW = 189.17 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C10H7NO3.
