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621-23-8,MFCD00008385
Catalog No.:AA003DDR

621-23-8 | 1,3,5-Trimethoxybenzene

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  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003DDR
Chemical Name:
1,3,5-Trimethoxybenzene
CAS Number:
621-23-8
Molecular Formula:
C9H12O3
Molecular Weight:
168.1898
MDL Number:
MFCD00008385
SMILES:
COc1cc(OC)cc(c1)OC
NSC Number:
90060
Properties
Properties
 
BP:
255°C at 760 mmHg  
Form:
Solid  
MP:
5-53 °C(lit.)  
Refractive Index:
1,533  
Solubility:
methanol: 0.1 g/mL, clear, colorless  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
91.2  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
3  
XLogP3:
2  

Literature

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Journal: The Journal of organic chemistry 20121019

Title: Stereoselective assembly of complex oligosaccharides using anomeric sulfonium ions as glycosyl donors.

Journal: Journal of the American Chemical Society 20120502

Title: Stereoselective glycosylations using oxathiane spiroketal glycosyl donors.

Journal: Carbohydrate research 20120201

Title: Quantitative NMR: an applicable method for quantitative analysis of medicinal plant extracts and herbal products.

Journal: Phytochemical analysis : PCA 20120101

Title: Direct functionalization of (un)protected tetrahydroisoquinoline and isochroman under iron and copper catalysis: two metals, two mechanisms.

Journal: The Journal of organic chemistry 20111104

Title: (2E)-1-(Pyridin-2-yl)-3-(2,4,6-trimeth-oxy-phen-yl)prop-2-en-1-one.

Journal: Acta crystallographica. Section E, Structure reports online 20111001

Title: Trimethoxybenzene complexes of pentafluorophenylchlorocarbene.

Journal: The journal of physical chemistry. A 20110721

Title: (E)-1-(4-Meth-oxy-phen-yl)-3-(2,4,6-trimeth-oxy-phen-yl)prop-2-en-1-one.

Journal: Acta crystallographica. Section E, Structure reports online 20110601

Title: (1E,4E)-1,5-Bis(2,4,6-trimeth-oxy-phen-yl)penta-1,4-dien-3-one.

Journal: Acta crystallographica. Section E, Structure reports online 20110101

Title: Solvolyses of benzoyl chlorides in weakly nucleophilic media.

Journal: International journal of molecular sciences 20110101

Title: Genomic approach to study floral development genes in Rosa sp.

Journal: PloS one 20110101

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: (E)-1-(2-Fur-yl)-3-(2,4,6-trimeth-oxy-phen-yl)prop-2-en-1-one.

Journal: Acta crystallographica. Section E, Structure reports online 20101001

Title: Synthesis and antitumor activity of diterpenylhydroquinone derivatives of natural ent-labdanes.

Journal: Molecules (Basel, Switzerland) 20100917

Title: A carbene-carbene complex equilibrium.

Journal: Journal of the American Chemical Society 20100811

Title: Synthesis and biological evaluation of a novel series of 2,2-bisaminomethylated aurone analogues as anti-inflammatory and antimicrobial agents.

Journal: European journal of medicinal chemistry 20100701

Title: Mesit-yl(2,4,6-trimeth-oxy-phen-yl)borinic acid.

Journal: Acta crystallographica. Section E, Structure reports online 20100701

Title: Solvation of dichlorocarbene: complexation with aryl ethers.

Journal: The journal of physical chemistry. A 20100114

Title: 6-(4-Bromo-phen-yl)-2-eth-oxy-4-(2,4,6-trimethoxy-phen-yl)nicotinonitrile.

Journal: Acta crystallographica. Section E, Structure reports online 20091101

Title: Ozonolysis of lignin models in aqueous solution: anisole, 1,2-dimethoxybenzene, 1,4-dimethoxybenzene, and 1,3,5-trimethoxybenzene.

Journal: Environmental science & technology 20090815

Title: (E)-1-(4-Bromo-phen-yl)-3-(2,4,6-trimethoxy-phen-yl)prop-2-en-1-one.

Journal: Acta crystallographica. Section E, Structure reports online 20090401

Title: Development of a coupled diffusion denuder system combined with gas chromatography/mass spectrometry for the separation and quantification of molecular iodine and the activated iodine compounds iodine monochloride and hypoiodous acid in the marine atmosphere.

Journal: Analytical chemistry 20090301

Title: Total synthesis of wasabidienones B1 and B0 via SIBX-mediated hydroxylative phenol dearomatization.

Journal: Organic letters 20081120

Title: A denuder-impinger system with in situ derivatization followed by gas chromatography-mass spectrometry for the determination of gaseous iodine-containing halogen species.

Journal: Journal of chromatography. A 20081114

Title: C3 vanadium(V) amine triphenolate complexes: vanadium haloperoxidase structural and functional models.

Journal: Inorganic chemistry 20081006

Title: A xerogel-sequestered selenoxide catalyst for brominations with hydrogen peroxide and sodium bromide in an aqueous environment.

Journal: The Journal of organic chemistry 20080905

Title: Validation of a quantitative NMR method for suspected counterfeit products exemplified on determination of benzethonium chloride in grapefruit seed extracts.

Journal: Journal of pharmaceutical and biomedical analysis 20080805

Title: Leaf essential oil composition of three species of Myrcianthes from Monteverde, Costa Rica.

Journal: Chemistry & biodiversity 20080701

Title: Investigation of the dynamic stereochemistry of dimesityl-2,4,6-trimethoxyphenylmethane by complete lineshape analysis and 2D EXSY NMR spectroscopy.

Journal: Magnetic resonance in chemistry : MRC 20080401

Title: Sila-haloperidol, a silicon analogue of the dopamine (D2) receptor antagonist haloperidol: synthesis, pharmacological properties, and metabolic fate.

Journal: ChemMedChem 20080101

Title: Electron capture in charge-tagged peptides. Evidence for the role of excited electronic states.

Journal: Journal of the American Society for Mass Spectrometry 20071201

Title: Bimolecular hole transfer from the trimethoxybenzene radical cation in the excited state.

Journal: The journal of physical chemistry. A 20070607

Title: Acute exacerbation of pain in irritable bowel syndrome: efficacy of phloroglucinol/trimethylphloroglucinol. A randomized, double-blind, placebo-controlled study.

Journal: Alimentary pharmacology & therapeutics 20070501

Title: One-electron oxidation of alcohols by the 1,3,5-trimethoxybenzene radical cation in the excited state during two-color two-laser flash photolysis.

Journal: The journal of physical chemistry. A 20070315

Title: Solvent-free iodination of organic molecules using the I(2)/urea-H(2)O(2) reagent system.

Journal: Organic & biomolecular chemistry 20070221

Title: The behavior of exciplex decay processes and interplay of radiationless transition and preliminary reorganization mechanisms of electron transfer in loose and tight pairs of reactants.

Journal: The journal of physical chemistry. A 20070118

Title: Tissue-specific mRNA expression profiling in grape berry tissues.

Journal: BMC genomics 20070101

Title: Transcriptomic and metabolite analyses of Cabernet Sauvignon grape berry development.

Journal: BMC genomics 20070101

Title: Facile synthesis of 1,3,7-trihydroxyxanthone and its regioselective coupling reactions with prenal: simple and efficient access to osajaxanthone and nigrolineaxanthone F.

Journal: The Journal of organic chemistry 20060623

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

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Title: In vitro availability of trimethylphloroglucinol and its degradation product from dosage formulations by RP-HPLC.

Journal: Pakistan journal of pharmaceutical sciences 20051001

Title: Control of extremely fast competitive consecutive reactions using micromixing. Selective Friedel-Crafts aminoalkylation.

Journal: Journal of the American Chemical Society 20050824

Title: Synthesis, characterization, and PGSE (1H and 19F) NMR diffusion studies on cationic (eta6- arene)Mn(CO)3+ complexes: boron counterion, ion pairing, and solvent dependences.

Journal: Inorganic chemistry 20050808

Title: Adsorption of single-ring organic compounds to wood charcoals prepared under different thermochemical conditions.

Journal: Environmental science & technology 20050601

Title: The key role of phloroglucinol O-methyltransferase in the biosynthesis of Rosa chinensis volatile 1,3,5-trimethoxybenzene.

Journal: Plant physiology 20040501

Title: Computational insight into the reaction intermediates in the glycosylation reaction assisted by donor heteroatoms.

Journal: The Journal of organic chemistry 20030207

Title: Two O-methyltransferases isolated from flower petals of Rosa chinensis var. spontanea involved in scent biosynthesis.

Journal: Journal of bioscience and bioengineering 20030101

Title: Biosynthesis of the major scent components 3,5-dimethoxytoluene and 1,3,5-trimethoxybenzene by novel rose O-methyltransferases.

Journal: FEBS letters 20020717

Title: Reactions of N-methyl-N-(4-biphenylyl)nitrenium ion with electron-rich arenes: laser flash photolysis and product studies.

Journal: Journal of the American Chemical Society 20020410

Title: Metallocyclic receptors with Re(I)/Os(II)-based moieties: molecular photophysics and selective molecular sensing.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20010601

Title: Studies in polyphenol chemistry and bioactivity. 3.(1,2) stereocontrolled synthesis of epicatechin-4alpha,8-epicatechin, an unnatural isomer of the B-type procyanidins.

Journal: The Journal of organic chemistry 20010223

Title: Wu S, et al. The key role of phloroglucinol O-methyltransferase in the biosynthesis of Rosa chinensis volatile 1,3,5-trimethoxybenzene. Plant Physiol. 2004 May;135(1):95-102.

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