Details
Stereochemistry | ACHIRAL |
Molecular Formula | C13H10O |
Molecular Weight | 182.2179 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O=C(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChIKey=RWCCWEUUXYIKHB-UHFFFAOYSA-N
InChI=1S/C13H10O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
Molecular Formula | C13H10O |
Molecular Weight | 182.2179 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
DescriptionSources: http://www.drugbank.ca/drugs/DB01878Curator's Comment: Description was created using several sources including:
http://apps.who.int/iris/bitstream/10665/42578/1/WHO_TRS_909.pdf; http://www.fda.gov/food/ingredientspackaginglabeling/foodadditivesingredients/ucm091048.htm; http://www.fda.gov/downloads/drugs/developmentapprovalprocess/developmentresources/over-the-counterotcdrugs/statusofotcrulemakings/ucm090435.pdf; https://dailymed.nlm.nih.gov/dailymed/drugInfo.cfm?setid=5a68508b-f1fa-4f03-b28a-554e24cf58d6; https://clinicaltrials.gov/ct2/show/NCT01695356?term=BENZOPHENONE&rank=1; https://clinicaltrials.gov/ct2/show/NCT01695356?term=BENZOPHENONE&rank=1; https://www.ncbi.nlm.nih.gov/pubmed/26753716
Sources: http://www.drugbank.ca/drugs/DB01878
Curator's Comment: Description was created using several sources including:
http://apps.who.int/iris/bitstream/10665/42578/1/WHO_TRS_909.pdf; http://www.fda.gov/food/ingredientspackaginglabeling/foodadditivesingredients/ucm091048.htm; http://www.fda.gov/downloads/drugs/developmentapprovalprocess/developmentresources/over-the-counterotcdrugs/statusofotcrulemakings/ucm090435.pdf; https://dailymed.nlm.nih.gov/dailymed/drugInfo.cfm?setid=5a68508b-f1fa-4f03-b28a-554e24cf58d6; https://clinicaltrials.gov/ct2/show/NCT01695356?term=BENZOPHENONE&rank=1; https://clinicaltrials.gov/ct2/show/NCT01695356?term=BENZOPHENONE&rank=1; https://www.ncbi.nlm.nih.gov/pubmed/26753716
Benzophenone is the organic compound. It is a flavouring agent evaluated as safe at current levels of intake by joint FAO/WHO Expert Committee on Food Additives (JECFA) and approved by FDA as a food additive and as UV protector. Substituted benzophenones such as oxybenzone (benzophenone-3) and dioxybenzone are used in sunscreens in cosmetics and as a sunscreen ingredients in some topical drugs in combination with skin lighteners for gradual fading of dark (brownish) areas in the skin such as freckles, age and liver spots or treatment of melanosis. Benzophenone derivatives can be used as a photo initiators. Benzophenone used in practical synthesis of some drugs.
Originator
Sources: http://www.orgsyn.org/demo.aspx?prep=cv1p0095
Curator's Comment: C. S. Marvel and W. M. Sperry described the synthesis of benzothenone in 1928
Approval Year
PubMed
Title | Date | PubMed |
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Time-resolved spectroscopy of sulfur- and carboxy-substituted N-alkylphthalimides. | 2001 Apr 1 |
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O-Methylephedrine: a versatile and highly efficient ortho-directing group. Synthesis of enantiopure 1,2-disubstituted ferrocene derivatives. | 2001 Dec 28 |
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The production of reactive oxygen species by irradiated camphorquinone-related photosensitizers and their effect on cytotoxicity. | 2001 May |
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Comparison of DNA damage photoinduced by ketoprofen, fenofibric acid and benzophenone via electron and energy transfer. | 2001 Nov |
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Hydrogen abstraction from ionic liquids by benzophenone triplet excited states. | 2001 Nov 21 |
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[Photoaggravated contact allergy and contact photoallergy caused by ketoprofen: 19 cases]. | 2001 Oct |
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Exploration of novel aryl binding sites of farnesyltransferase using molecular modeling and benzophenone-based farnesyltransferase inhibitors. | 2001 Sep 13 |
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Solid-phase microextraction and gas chromatography-mass spectrometry analysis of p,p' -DDE in biological samples. | 2001 Sep 15 |
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Slow photo-cross-linking kinetics of benzophenone-labeled voltage sensors of ion channels. | 2001 Sep 4 |
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Oxygen transfer from sulfoxides: oxidation of alkylarenes catalyzed by a polyoxomolybdate, [PMo12O40]3-. | 2002 Apr 24 |
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[Determination of alkylphenols, bisphenol A, benzophenone and phthalates in containers of baby food, and migration into food simulants]. | 2002 Aug |
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4,4'-Benzophenone-O,O'-disulfamate: a potent inhibitor of steroid sulfatase. | 2002 Aug 19 |
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Migration of surrogate contaminants in paper and paperboard into water through polyethylene coating layer. | 2002 Dec |
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Benzophenone-induced estrogenic potency in ovariectomized rats. | 2002 Dec |
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Structure-reactivity relationships in the photoreduction of n,pi*-excited ketones and azoalkanes: the effect of reaction thermodynamics, excited-state electrophilicity, and antibonding character in the transition state. | 2002 Feb |
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Methionine proximity assay, a novel method for exploring peptide ligand-receptor interaction. | 2002 Feb-Nov |
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Oxidation of sulfides and disulfides under electron transfer or singlet oxygen photosensitization using soluble or grafted sensitizers. | 2002 May |
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[Cross-reaction potentials of ketoprofen]. | 2002 May 12 |
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Molecular structure of the solvated proton in isolated salts. Short, strong, low barrier (SSLB) H-bonds. | 2002 Nov 20 |
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p-Nitrobenzenesulfenate esters as precursors for laser flash photolysis studies of alkyl radicals. | 2002 Nov 29 |
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Biotransformation of cyclizine in greyhounds. 2: N(1)-dealkylation and identification of some neutral and phenolic metabolites in canine urine by gas chromatography-mass spectrometry. | 2002 Sep |
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Determination of benzophenones in a cosmetic matrix by supercritical fluid extraction and capillary electrophoresis. | 2003 Feb 14 |
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Cryptophycin affinity labels: synthesis and biological activity of a benzophenone analogue of cryptophycin-24. | 2003 Feb 24 |
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New series of N-substituted phenyl ketone oxime ethers: synthesis and bovine beta3-adrenergic agonistic activities. | 2003 Jan |
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Tuning copper-dioxygen reactivity and exogenous substrate oxidations via alterations in ligand electronics. | 2003 Jan 22 |
Patents
Sample Use Guides
Apply a small amount of gel as a thin layer on the affected area twice daily, or use as directed by a doctor (50 g of gel contains 1 g of hydroquinone and 0.05 g benzophenone)
Route of Administration:
Topical
In Vitro Use Guide
Sources: https://www.ncbi.nlm.nih.gov/pubmed/26753716
The patterned co-culture of different types of living cells in a microfluidic device is crucial for the analysis of cellular interactions and cell-cell communication. Cell patterning was achieved by photocrosslinking 0.2 M benzophenone-4-isocyocyanate in a microfluidic channel. Patterning and co-culture of non-adherent K562 cells and adherent RF-6A cells was achieved by successive rounds of patterning. The present approach is expected to be useful for the development of in vitro methods for studying cell signaling.
Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Jul 05 22:29:48 UTC 2023
by
admin
on
Wed Jul 05 22:29:48 UTC 2023
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Record UNII |
701M4TTV9O
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Record Status |
Validated (UNII)
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Record Version |
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Classification Tree | Code System | Code | ||
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JECFA EVALUATION |
BENZOPHENONE
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CFR |
21 CFR 172.515
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EPA PESTICIDE CODE |
315
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DTXSID0021961
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6809
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1056130
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119-61-9
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SUB13019MIG
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BENZOPHENONE
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8077
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3102
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M2370
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100000077159
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41308
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701M4TTV9O
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204-337-6
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DB01878
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18997
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C047723
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701M4TTV9O
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PARENT -> IMPURITY |
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PARENT -> IMPURITY |
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PARENT -> IMPURITY |
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ACTIVE MOIETY |