5-chloro-2-hydroxybenzophenone
Product Information
Molecular Formula
C13H9ClO2
Molecular Weight
232.66
Description
UV absorber
Synonyms
(5-chloro-2-hydroxyphenyl)phenyl-methanon; 2-benzoyl-4-chlorophenol; 3-chloro-6-hydroxybenzophenone; 5-chloro-2-hydroxy-benzophenon; benzophenone,5-chloro-2-hydroxy-; benzophenone-7; benzophenone-7,5-chloro-2-hydroxybenzophenone; chlorohydroxybenzophenone
IUPAC Name
(5-chloro-2-hydroxyphenyl)-phenylmethanone
SMILES
C1=CC=C(C=C1)C(=O)C2=C(C=CC(=C2)Cl)O
InChI
InChI=1S/C13H9ClO2/c14-10-6-7-12(15)11(8-10)13(16)9-4-2-1-3-5-9/h1-8,15H
InChI Key
OMWSZDODENFLSV-UHFFFAOYSA-N
Boiling Point
355.5°C(lit.)
Melting Point
96-98°C
Flash Point
235.4 °F
Purity
95%
Density
1.307 g/cm3
Solubility
In water, 52.3 mg/L at 25 °C (est)
Appearance
powder
Application
Used as light absorber.
Refractive Index
n20/D 1.479 (lit.)
Stability
Stable under recommended storage conditions.
LogP
log Kow = 4.09 (est)
Vapor Pressure
4.44X10-6 mm Hg at 25 °C (est)
Henry's Law Constant
1.89X10-7 atm-cu m/mol at 25 °C (est)
Odor
Nearly odorless
Computed Properties
XLogP3
3.9
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Rotatable Bond Count
2
Exact Mass
232.0291072 g/mol
Monoisotopic Mass
232.0291072 g/mol
Topological Polar Surface Area
37.3Ų
Heavy Atom Count
16
Formal Charge
0
Complexity
248
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-114149769-A | High-reflection black adhesive film and preparation method and application thereof | 2021-12-29 |
| CN-113968965-A | Semi-aromatic polyamide and preparation method and application thereof | 2021-12-01 |
| CN-114149754-A | Grid adhesive film and preparation method and application thereof | 2021-11-30 |
| CN-113930139-A | Bottom coating composition for diffusion film and diffusion film thereof | 2021-10-14 |
| CN-113698564-A | Sulfur-containing benzophenone polyurethane modified epoxy acrylate self-initiated UV resin | 2021-08-05 |
| CN-113717365-A | Sulfur-containing benzophenone modified 3 rd generation dendritic self-initiation UV resin | 2021-08-05 |
| CN-113717366-A | Hyperbranched self-initiated photocuring resin modified by sulfur-containing benzophenone | 2021-08-05 |
| CN-113717367-A | Sulfur-containing benzophenone modified 2 nd-generation hyperbranched self-initiated UV resin | 2021-08-05 |
| CN-112411192-A | Humidity-adjusting and ultraviolet-resistant fabric surface treating agent and preparation method and application thereof | 2020-11-18 |
| WO-2021257518-A1 | Fluorosilicone polymers, compositions, and uses thereof | 2020-06-15 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 21578361 | 2009-10-17 | (E,E)-4,4'-Dichloro-2,2'-[azinobis(phenyl-methyl-idyne)]diphenol | Acta crystallographica. Section E, Structure reports online |
| 17514970 | 2007-02-01 | [Synthesis, characterization and fluorescence property of an unsymmetrical Schiff base and its copper complex] | Guang pu xue yu guang pu fen xi = Guang pu |
| 16497524 | 2006-11-01 | Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods | Journal of molecular graphics & modelling |
| 14532685 | 2003-10-01 | 5-chloro-2-hydroxybenzophenone, featuring O-H...O, C-H...O, C-H...pi and pi-pi interactions | Acta crystallographica. Section C, Crystal structure communications |
| 11266322 | 2001-02-01 | Estrogenic activity of phenolic additives determined by an in vitro yeast bioassay | Environmental health perspectives |
