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16052-42-9,MFCD00001481
Catalog No.:AA001RWR

16052-42-9 | Cyclohexane, 2-chloro-4-methyl-1-(1-methylethyl)-, (1S,2R,4R)-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$93.00   $65.00
- +
1g
98%
in stock  
$165.00   $115.00
- +
25g
98%
in stock  
$2,449.00   $1,714.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001RWR
Chemical Name:
Cyclohexane, 2-chloro-4-methyl-1-(1-methylethyl)-, (1S,2R,4R)-
CAS Number:
16052-42-9
Molecular Formula:
C10H19Cl
Molecular Weight:
174.7109
MDL Number:
MFCD00001481
SMILES:
C[C@@H]1CC[C@H]([C@@H](C1)Cl)C(C)C
NSC Number:
55430
Properties
Properties
 
BP:
216.1°C at 760 mmHg  
Form:
Liquid  
MP:
−20-−16.5℃ (lit.)  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
120  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
3  
Heavy Atom Count:
11  
Rotatable Bond Count:
1  
XLogP3:
4.3  

Downstream Synthesis Route

[1]Kuhwald,Conrad;Kirschning,Andreas[OrganicLetters,2021,vol.23,#11,p.4300-4304]

[2]Vedejs,Edwin;Donde,Yariv[JournalofOrganicChemistry,2000,vol.65,#8,p.2337-2343]

[3]Procter,D.John;Thornton-Pett,Mark;Rayner,ChristopherM.[Tetrahedron,1996,vol.52,#5,p.1841-1854]

[4]Minato,Makoto;Kaneko,Takefumi;Masauji,Shogo;Ito,Takashi[JournalofOrganometallicChemistry,2006,vol.691,#11,p.2483-2488]

[5]Rubial,Belén;Collins,BeatriceS.L.;Bigler,Raphael;Aichhorn,Stefan;Noble,Adam;Aggarwal,VarinderK.[AngewandteChemie-InternationalEdition,2019,vol.58,#5,p.1366-1370][Angew.Chem.,2019,vol.131,p.1380-1384,5]

[6]Wu,Xiangyu;Hao,Wei;Ye,Ke-Yin;Jiang,Binyang;Pombar,Gisselle;Song,Zhidong;Lin,Song[JournaloftheAmericanChemicalSociety,2018,vol.140,#44,p.14836-14843]

[7]Kurssanow[ZhurnalRusskagoFiziko-KhimicheskagoObshchestva,1914,vol.46,p.821][ChemischesZentralblatt,1915,vol.86,#I,p.893]Kurssanow[ZhurnalRusskagoFiziko-KhimicheskagoObshchestva,1916,vol.48,p.872][ChemischesZentralblatt,1923,vol.94,#III,p.757]

[8]Kurssanow[ZhurnalRusskagoFiziko-KhimicheskagoObshchestva,1914,vol.46,p.821][ChemischesZentralblatt,1915,vol.86,#I,p.893]Kurssanow[ZhurnalRusskagoFiziko-KhimicheskagoObshchestva,1916,vol.48,p.872][ChemischesZentralblatt,1923,vol.94,#III,p.757]

[9]Jiang,Qiongzhong;Rueegger,Heinz;Venanzi,LuigiM.[JournalofOrganometallicChemistry,1995,vol.488,#1-2,p.233-240]

[10]Smith;Wright[JournalofOrganicChemistry,1952,vol.17,p.1116,1120]

[11]Ortega,Nuria;Feher-Voelger,Andres;Brovetto,Margarita;Padron,JuanI.;Martin,VictorS.;Martin,Tomas[AdvancedSynthesisandCatalysis,2011,vol.353,#6,p.963-972]

[12]Mondal,Deboprosad;Li,SongYe;Bellucci,Luca;Laino,Teodoro;Tafi,Andrea;Guccione,Salvatore;Lepore,SalvatoreD.[JournalofOrganicChemistry,2013,vol.78,#5,p.2118-2127]

[13]Senaratne,PushpanandaA.;Orihuela,FelixM.;Malcolm,ArcelioJ.;Anderson,KeithG.[OrganicProcessResearchandDevelopment,2003,vol.7,#2,p.185-186]

[14]Hintermann,Lukas;Wong,KitMing[EuropeanJournalofOrganicChemistry,2017,vol.2017,#37,p.5527-5536]

[15]Hintermann,Lukas;Wong,KitMing[EuropeanJournalofOrganicChemistry,2017,vol.2017,#37,p.5527-5536]

[16]CurrentPatentAssignee:LIAOCHENGUNIVERSITY-CN108164561,2018,ALocationinpatent:Paragraph0062;0067

[17]CurrentPatentAssignee:APPLEFLAVORANDFRAGRANCEGROUPCOLTD-CN111484422,2020,ALocationinpatent:Paragraph0055-0063

[18]Abás,Sònia;Escolano,Carmen;Galdeano,Carles;Pujol,Eugènia;Rodríguez-Arévalo,Sergio;Vázquez,Santiago[Molecules,2021,vol.26,#4]

[1]JournalofOrganometallicChemistry,1981,vol.210,p.9-18

[1]Pfeiffer,Heinz-Peter;Sander,Hiltrud;Breitmaier,Eberhard[LiebigsAnnalenderChemie,1987,p.725-726]

16052-42-9    567-19-1    18715-95-2   
(-)-3-(1'R)-1'-menthyl-1,2-benzisothiazole1,1-dioxide 
 
(+)-3-(1'S)-1'-menthyl-1,2-benzisothiazole1,1-dioxide 

[1]Bethell,Donald;Page,PhilipC.Bulman;Vahedi,Hooshang[JournalofOrganicChemistry,2000,vol.65,#20,p.6756-6760]

[1]JournalofFluorineChemistry,2001,vol.108,p.47-50

Literature
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Tags:16052-42-9 Molecular Formula|16052-42-9 MDL|16052-42-9 SMILES|16052-42-9 Cyclohexane, 2-chloro-4-methyl-1-(1-methylethyl)-, (1S,2R,4R)-