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638-28-8,MFCD00039351
Catalog No.:AA003GZR

638-28-8 | 2-Chlorohexane

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$115.00   $80.00
- +
5g
>98.0%(GC)
in stock  
$170.00   $119.00
- +
25g
>98.0%(GC)
in stock  
$547.00   $383.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003GZR
Chemical Name:
2-Chlorohexane
CAS Number:
638-28-8
Molecular Formula:
C6H13Cl
Molecular Weight:
120.6204
MDL Number:
MFCD00039351
SMILES:
CCCCC(Cl)C
Properties
Properties
 
BP:
122 °C  
Form:
Liquid  
MP:
-35.1°C (estimate)  
Refractive Index:
1.4150-1.4170  
Storage:
2-8℃;  

Computed Properties
 
Complexity:
35.2  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
7  
Hydrogen Bond Acceptor Count:
0  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3  

Downstream Synthesis Route

[1]Fuller,StevenE.;Smith,JohnR.Lindsay;Norman,RichardO.C.;Higgins,Raymond[JournaloftheChemicalSociety.PerkintransactionsII,1981,p.545-552]

[2]Davis,Reg;Durrant,JimL.A.;Rowland,ChristopherC.[JournalofOrganometallicChemistry,1986,vol.316,p.147-162]

[3]Michael;Turner[ChemischeBerichte,1906,vol.39,p.2153]

[4]Fuller,StevenE.;Smith,JohnR.Lindsay;Norman,RichardO.C.;Higgins,Raymond[JournaloftheChemicalSociety.PerkintransactionsII,1981,p.545-552]

[5]Davis,Reg;Durrant,JimL.A.;Rowland,ChristopherC.[JournalofOrganometallicChemistry,1986,vol.316,p.147-162]

[6]Vedernikov;Sayakhov;Zazybin;Solomonov[RussianJournalofOrganicChemistry,1998,vol.34,#6,p.812-815]

[7]Vedernikov;Sayakhov;Zazybin;Solomonov[RussianJournalofOrganicChemistry,1998,vol.34,#6,p.812-815]

[8]Quinn,RyanK.;Könst,ZefA.;Michalak,SharonE.;Schmidt,Yvonne;Szklarski,AnneR.;Flores,AlexR.;Nam,Sangkil;Horne,DavidA.;Vanderwal,ChristopherD.;Alexanian,ErikJ.[JournaloftheAmericanChemicalSociety,2016,vol.138,#2,p.696-702]

[9]Zhao,Mengdi;Lu,Wenjun[OrganicLetters,2017,vol.19,#17,p.4560-4563]

[10]Melo,IsisL.;Lube,LeonardoM.;Neves,EduardoS.;Terra,WagnerS.;Fernandes,Christiane;Matos,CarlosR.R.;Franco,RobertoW.A.;Resende,JacksonA.L.C.;Valente,DanielC.A.;Horta,BrunoA.C.;Cardozo,ThiagoM.;Horn,Adolfo[AppliedCatalysisA:General,2018,vol.562,p.150-158]

[11]Carestia,AnthonyM.;Ravelli,Davide;Alexanian,ErikJ.[ChemicalScience,2018,vol.9,#24,p.5360-5365]

[12]Liu,Shouxin;Zhang,Qi;Tian,Xia;Fan,Shiming;Huang,Jing;Whiting,Andrew[GreenChemistry,2018,vol.20,#20,p.4729-4737]

[13]McMillan,AlastairJ.;Sieńkowska,Martyna;DiLorenzo,Piero;Gransbury,GemmaK.;Chilton,NicholasF.;Salamone,Michela;Ruffoni,Alessandro;Bietti,Massimo;Leonori,Daniele[AngewandteChemie-InternationalEdition,2021,vol.60,#13,p.7132-7139][Angew.Chem.,2021,vol.133,#13,p.7208-7215,8]

[1]Khusnutdinov,R.I.;Shchadneva,N.A.;Dzhemilev,U.M.;Tolstikov,G.A.[BulletinoftheAcademyofSciencesoftheUSSRDivisionofChemicalScience,1991,vol.40,#6.2,p.1213-1217][IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1991,#6,p.1373-1377]

[1]Vedernikov;Zazybin;Borisoglebskii;Solomonov[RussianJournalofGeneralChemistry,1996,vol.66,#12,p.1922-1924]

[1]Keramane,ElMehdi;Boyer,Bernard;Roque,Jean-Pierre[Tetrahedron,2001,vol.57,#10,p.1909-1916]

[1]CurrentPatentAssignee:SHELLPLC-US2005/245771,2005,A1Locationinpatent:Page/Pagecolumn4

[2]CurrentPatentAssignee:SHELLPLC-US2005/245771,2005,A1Locationinpatent:Page/Pagecolumn5

[3]CurrentPatentAssignee:SHELLPLC-US2005/245771,2005,A1Locationinpatent:Page/Pagecolumn5

[4]CurrentPatentAssignee:SHELLPLC-US2005/245771,2005,A1Locationinpatent:Page/Pagecolumn5

[5]CurrentPatentAssignee:SHELLPLC-US2005/245777,2005,A1Locationinpatent:Page/Pagecolumn4

[6]CurrentPatentAssignee:SHELLPLC-US2005/245777,2005,A1Locationinpatent:Page/Pagecolumn5

[7]CurrentPatentAssignee:SHELLPLC-US2005/245777,2005,A1Locationinpatent:Page/Pagecolumn5

[8]CurrentPatentAssignee:SHELLPLC-US2005/245777,2005,A1Locationinpatent:Page/Pagecolumn5

Literature

Title: Sulfur mustard toxicity following dermal exposure: role of oxidative stress, and antioxidant therapy.

Journal: Journal of burns and wounds 20070101

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SDS
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Historical Records
1240590-86-6

1240590-86-6
Tags:638-28-8 Molecular Formula|638-28-8 MDL|638-28-8 SMILES|638-28-8 2-Chlorohexane
Catalog No.: AA003GZR
638-28-8,MFCD00039351
638-28-8 | 2-Chlorohexane
Pack Size： 1g
Purity： 98%
in stock
$115.00 $80.00
Pack Size： 5g
Purity： >98.0%(GC)
in stock
$170.00 $119.00
Pack Size： 25g
Purity： >98.0%(GC)
in stock
$547.00 $383.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003GZR
Chemical Name: 2-Chlorohexane
CAS Number: 638-28-8
Molecular Formula: C6H13Cl
Molecular Weight: 120.6204
MDL Number: MFCD00039351
SMILES: CCCCC(Cl)C
Properties
BP: 122 °C  
Form: Liquid  
MP: -35.1°C (estimate)  
Refractive Index: 1.4150-1.4170  
Storage: 2-8℃;  
Complexity: 35.2  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 7  
Hydrogen Bond Acceptor Count: 0  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3  
Downstream Synthesis Route
110-54-3    638-28-8    544-10-5    2346-81-8 

[1]Fuller,StevenE.;Smith,JohnR.Lindsay;Norman,RichardO.C.;Higgins,Raymond[JournaloftheChemicalSociety.PerkintransactionsII,1981,p.545-552]

[2]Davis,Reg;Durrant,JimL.A.;Rowland,ChristopherC.[JournalofOrganometallicChemistry,1986,vol.316,p.147-162]

[3]Michael;Turner[ChemischeBerichte,1906,vol.39,p.2153]

[4]Fuller,StevenE.;Smith,JohnR.Lindsay;Norman,RichardO.C.;Higgins,Raymond[JournaloftheChemicalSociety.PerkintransactionsII,1981,p.545-552]

[5]Davis,Reg;Durrant,JimL.A.;Rowland,ChristopherC.[JournalofOrganometallicChemistry,1986,vol.316,p.147-162]

[6]Vedernikov;Sayakhov;Zazybin;Solomonov[RussianJournalofOrganicChemistry,1998,vol.34,#6,p.812-815]

[7]Vedernikov;Sayakhov;Zazybin;Solomonov[RussianJournalofOrganicChemistry,1998,vol.34,#6,p.812-815]

[8]Quinn,RyanK.;Könst,ZefA.;Michalak,SharonE.;Schmidt,Yvonne;Szklarski,AnneR.;Flores,AlexR.;Nam,Sangkil;Horne,DavidA.;Vanderwal,ChristopherD.;Alexanian,ErikJ.[JournaloftheAmericanChemicalSociety,2016,vol.138,#2,p.696-702]

[9]Zhao,Mengdi;Lu,Wenjun[OrganicLetters,2017,vol.19,#17,p.4560-4563]

[10]Melo,IsisL.;Lube,LeonardoM.;Neves,EduardoS.;Terra,WagnerS.;Fernandes,Christiane;Matos,CarlosR.R.;Franco,RobertoW.A.;Resende,JacksonA.L.C.;Valente,DanielC.A.;Horta,BrunoA.C.;Cardozo,ThiagoM.;Horn,Adolfo[AppliedCatalysisA:General,2018,vol.562,p.150-158]

[11]Carestia,AnthonyM.;Ravelli,Davide;Alexanian,ErikJ.[ChemicalScience,2018,vol.9,#24,p.5360-5365]

[12]Liu,Shouxin;Zhang,Qi;Tian,Xia;Fan,Shiming;Huang,Jing;Whiting,Andrew[GreenChemistry,2018,vol.20,#20,p.4729-4737]

[13]McMillan,AlastairJ.;Sieńkowska,Martyna;DiLorenzo,Piero;Gransbury,GemmaK.;Chilton,NicholasF.;Salamone,Michela;Ruffoni,Alessandro;Bietti,Massimo;Leonori,Daniele[AngewandteChemie-InternationalEdition,2021,vol.60,#13,p.7132-7139][Angew.Chem.,2021,vol.133,#13,p.7208-7215,8]

592-41-6    638-28-8    2346-81-8 

[1]Khusnutdinov,R.I.;Shchadneva,N.A.;Dzhemilev,U.M.;Tolstikov,G.A.[BulletinoftheAcademyofSciencesoftheUSSRDivisionofChemicalScience,1991,vol.40,#6.2,p.1213-1217][IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1991,#6,p.1373-1377]

56-23-5    110-54-3    638-28-8    67-66-3    544-10-5    2346-81-8 

[1]Vedernikov;Zazybin;Borisoglebskii;Solomonov[RussianJournalofGeneralChemistry,1996,vol.66,#12,p.1922-1924]

626-93-7    638-28-8    2346-81-8    592-43-8 

[1]Keramane,ElMehdi;Boyer,Bernard;Roque,Jean-Pierre[Tetrahedron,2001,vol.57,#10,p.1909-1916]

638-28-8    544-10-5    2346-81-8 

[1]CurrentPatentAssignee:SHELLPLC-US2005/245771,2005,A1Locationinpatent:Page/Pagecolumn4

[2]CurrentPatentAssignee:SHELLPLC-US2005/245771,2005,A1Locationinpatent:Page/Pagecolumn5

[3]CurrentPatentAssignee:SHELLPLC-US2005/245771,2005,A1Locationinpatent:Page/Pagecolumn5

[4]CurrentPatentAssignee:SHELLPLC-US2005/245771,2005,A1Locationinpatent:Page/Pagecolumn5

[5]CurrentPatentAssignee:SHELLPLC-US2005/245777,2005,A1Locationinpatent:Page/Pagecolumn4

[6]CurrentPatentAssignee:SHELLPLC-US2005/245777,2005,A1Locationinpatent:Page/Pagecolumn5

[7]CurrentPatentAssignee:SHELLPLC-US2005/245777,2005,A1Locationinpatent:Page/Pagecolumn5

[8]CurrentPatentAssignee:SHELLPLC-US2005/245777,2005,A1Locationinpatent:Page/Pagecolumn5

Literature fold

Title: Sulfur mustard toxicity following dermal exposure: role of oxidative stress, and antioxidant therapy.

Journal: Journal of burns and wounds20070101

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