4,4'-Dihydroxybenzophenone
Product Information
Molecular Formula
C13H10O3
Molecular Weight
214.22
Description
4,4'-Dihydroxybenzophenone (CAS# 611-99-4) is a compound useful in organic synthesis.
Synonyms
bis(4-hydroxyphenyl)methanone; bis(4-hydroxyphenyl)methanone
IUPAC Name
bis(4-hydroxyphenyl)methanone
SMILES
C1=CC(=CC=C1C(=O)C2=CC=C(C=C2)O)O
InChI
InChI=1S/C13H10O3/c14-11-5-1-9(2-6-11)13(16)10-3-7-12(15)8-4-10/h1-8,14-15H
InChI Key
RXNYJUSEXLAVNQ-UHFFFAOYSA-N
Boiling Point
419-420 °C (lit.)
Melting Point
221 °C
Flash Point
303.8 °F
Purity
> 98.0 % (GC) (T)
Density
1.1330 g/cm3
Appearance
White to light red to green powder to crystal
Storage
2-8 °C
Refractive Index
1.5090 (estimate)
LogP
2.32880
Safety Information
Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P261, P264, P271, P272, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P333+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
XLogP3
2.7
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
2
Exact Mass
214.062994177 g/mol
Monoisotopic Mass
214.062994177 g/mol
Topological Polar Surface Area
57.5Ų
Heavy Atom Count
16
Formal Charge
0
Complexity
212
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-114149734-A | Reflective heat-insulation polyurethane waterproof coating and preparation method thereof | 2021-12-28 |
| CN-113861638-A | Preparation method of modified polyester and application of modified polyester in polyester film for dry film resist | 2021-12-02 |
| CN-114044870-A | Polyurethane chain extender and preparation method thereof, and casting polyurethane elastomer and preparation method thereof | 2021-12-02 |
| CN-114030255-A | Heat insulation board for cold chain system | 2021-11-30 |
| CN-113637153-A | Multi-block polyether type high-molecular surfactant and preparation method and application thereof | 2021-10-18 |
| CN-113637154-A | Nonionic polyether type high-molecular surfactant and preparation method and application thereof | 2021-10-18 |
| CN-113637155-A | Anionic polyether type high-molecular surfactant and preparation method thereof | 2021-10-18 |
| CN-113912810-A | Single-component aqueous polyurethane dispersion and preparation method thereof | 2021-10-12 |
| CN-113769592-A | Quaternized modified polyarylether membrane material and preparation method and application thereof | 2021-09-18 |
| CN-113683495-A | Method for preparing 4,4' -dihydroxy benzophenone | 2021-09-16 |
Literatures
| PMID | Publication Date | Title | Journal |
|---|---|---|---|
| 22487399 | 2012-08-15 | Degradation of UV filters in sewage sludge and 4-MBC in liquid medium by the ligninolytic fungus Trametes versicolor | Journal of environmental management |
| 21701897 | 2011-12-01 | Synthesis of hydroxyferrocifen and its abilities to protect DNA and to scavenge radicals | Journal of biological inorganic chemistry : JBIC : a publication of the Society of Biological Inorganic Chemistry |
| 21530995 | 2011-08-01 | Occurrence of multiclass UV filters in treated sewage sludge from wastewater treatment plants | Chemosphere |
| 21589049 | 2010-10-20 | 4-(4-Hydroxybenzoyl)phenol mono-hydrate | Acta crystallographica. Section E, Structure reports online |
| 19640715 | 2009-09-01 | A chemical screening approach reveals that indole fluorescence is quenched by pre-fibrillar but not fibrillar amyloid-beta | Bioorganic & medicinal chemistry letters |
| 18367444 | 2008-05-30 | X-ray structure of 4,4'-dihydroxybenzophenone mimicking sterol substrate in the active site of sterol 14alpha-demethylase (CYP51) | The Journal of biological chemistry |
| 18088140 | 2008-01-18 | Convenient one-pot synthesis of 2,2-bis-(4-hydroxyphenyl)-cyclopentanone | The Journal of organic chemistry |
| 18024680 | 2008-01-01 | Degradation of Bis(4-Hydroxyphenyl)methane (bisphenol F) by Sphingobium yanoikuyae strain FM-2 isolated from river water | Applied and environmental microbiology |
| 17208445 | 2007-03-01 | Synthesis and antimycobacterial evaluation of benzofurobenzopyran analogues | Bioorganic & medicinal chemistry |
| 16497524 | 2006-11-01 | Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods | Journal of molecular graphics & modelling |
