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88-27-7,MFCD00026283
Catalog No.:AA003G3E

88-27-7 | N,N-dimethyl-3,5-di-tert-butyl-4-hydroxybenzylamine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
500g
98%
in stock  
$17.00   $12.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003G3E
Chemical Name:
N,N-dimethyl-3,5-di-tert-butyl-4-hydroxybenzylamine
CAS Number:
88-27-7
Molecular Formula:
C17H29NO
Molecular Weight:
263.4183
MDL Number:
MFCD00026283
SMILES:
CN(Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)C
Properties
Properties
 
Form:
Solid  
MP:
93-94 °C(lit.)  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
261  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
4.7  

Downstream Synthesis Route

[1]Moehrle,H.;Schake,D.[ZeitschriftfurNaturforschung,B:ChemicalSciences,1995,vol.50,#12,p.1859-1868]

[2]Dyubchenko;Nikulina;Terakh;Kandalintseva;Markov;Grigor'Ev;Prosenko[PetroleumChemistry,2005,vol.45,#5,p.330-334]

[3]Gasanov,B.R.;Bilalov,S.B.[JournalofgeneralchemistryoftheUSSR,1988,vol.58,#5,p.961-966][ZhurnalObshcheiKhimii,1988,vol.58,#5,p.1082-1089]

[4]Coffieldetal.[JournaloftheAmericanChemicalSociety,1957,vol.79,p.5019,5021]Kharasch;Joshi[JournalofOrganicChemistry,1957,vol.22,p.1439,1442]

[5]Bilalov,S.B.;Alieva,F.D.;Gasanov,B.R.[JournalofOrganicChemistryUSSR(EnglishTranslation),1987,vol.23,#7,p.1355-1357][ZhurnalOrganicheskoiKhimii,1987,vol.23,#7,p.1508-1510]

[6]Roper,JerryM.;Everly,CharlesR.[JournalofOrganicChemistry,1988,vol.53,#11,p.2639-2642]

[7]Bugaev;Dmitriev;Prosenko[RussianChemicalBulletin,2012,vol.61,#2,p.298-302][Izv.Akad.Nauk,Ser.Khim.,2012,#2,p.297-301,5]

[8]CurrentPatentAssignee:JIANGSUMAIDANEWMAT-CN108250047,2018,ALocationinpatent:Paragraph0029;0030;0033;0036

[1]Zagidullin,R.N.[JournalofgeneralchemistryoftheUSSR,1991,vol.61,#1.2,p.225-230][ZhurnalObshcheiKhimii,1991,vol.61,#1,p.247-253]

[1]Nikiforov,G.A.;Bannikov,G.F.;Mal'donado,I.K.A.Romero;Malysheva,R.D.;Ershov,V.V.[BulletinoftheAcademyofSciencesoftheUSSRDivisionofChemicalScience,1989,vol.<1>38,#12,p.2530-2535][IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1989,#12,p.2765-2770]

[1]Nikiforov,G.A.;Bannikov,G.F.;Mal'donado,I.K.A.Romero;Malysheva,R.D.;Ershov,V.V.[BulletinoftheAcademyofSciencesoftheUSSRDivisionofChemicalScience,1989,vol.<1>38,#12,p.2530-2535][IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1989,#12,p.2765-2770]

1004-38-2    88-27-7   
2,6-Di-tert-butyl-4-(2,4,6-triamino-pyrimidin-5-ylmethyl)-phenol 

[1]JournalofMedicinalChemistry,1980,vol.23,p.535-541

Literature

Title: Anaerobic toxicity assay of plasticisers.

Journal: Journal of environmental science and health. Part A, Toxic/hazardous substances & environmental engineering 20120101

Title: Discovery of novel SERCA inhibitors by virtual screening of a large compound library.

Journal: European journal of medicinal chemistry 20110501

Title: Bis(1,2,2,6,6-penta-methyl-piperidin-4-yl) 2-butyl-2-(3,5-di-tert-butyl-4-hydroxy-benz-yl)malonate (Tinuvin 144).

Journal: Acta crystallographica. Section E, Structure reports online 20091001

Title: Dimethyl 2-butyl-2-(3,5-di-tert-butyl-4-hydroxy-benz-yl)malonate.

Journal: Acta crystallographica. Section E, Structure reports online 20091001

Title: Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.

Journal: Journal of molecular graphics & modelling 20061101

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

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

Title: Steroid hormone activity of flavonoids and related compounds.

Journal: Breast cancer research and treatment 20000701

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SDS
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Tags:88-27-7 Molecular Formula|88-27-7 MDL|88-27-7 SMILES|88-27-7 N,N-dimethyl-3,5-di-tert-butyl-4-hydroxybenzylamine
Catalog No.: AA003G3E
88-27-7,MFCD00026283
88-27-7 | N,N-dimethyl-3,5-di-tert-butyl-4-hydroxybenzylamine
Pack Size： 500g
Purity： 98%
in stock
$17.00 $12.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003G3E
Chemical Name: N,N-dimethyl-3,5-di-tert-butyl-4-hydroxybenzylamine
CAS Number: 88-27-7
Molecular Formula: C17H29NO
Molecular Weight: 263.4183
MDL Number: MFCD00026283
SMILES: CN(Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C)C
Properties
Form: Solid  
MP: 93-94 °C(lit.)  
Storage: Inert atmosphere;Room Temperature;  
Complexity: 261  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 19  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 4.7  
Downstream Synthesis Route
50-00-0    128-39-2    124-40-3    88-27-7 

[1]Moehrle,H.;Schake,D.[ZeitschriftfurNaturforschung,B:ChemicalSciences,1995,vol.50,#12,p.1859-1868]

[2]Dyubchenko;Nikulina;Terakh;Kandalintseva;Markov;Grigor'Ev;Prosenko[PetroleumChemistry,2005,vol.45,#5,p.330-334]

[3]Gasanov,B.R.;Bilalov,S.B.[JournalofgeneralchemistryoftheUSSR,1988,vol.58,#5,p.961-966][ZhurnalObshcheiKhimii,1988,vol.58,#5,p.1082-1089]

[4]Coffieldetal.[JournaloftheAmericanChemicalSociety,1957,vol.79,p.5019,5021]Kharasch;Joshi[JournalofOrganicChemistry,1957,vol.22,p.1439,1442]

[5]Bilalov,S.B.;Alieva,F.D.;Gasanov,B.R.[JournalofOrganicChemistryUSSR(EnglishTranslation),1987,vol.23,#7,p.1355-1357][ZhurnalOrganicheskoiKhimii,1987,vol.23,#7,p.1508-1510]

[6]Roper,JerryM.;Everly,CharlesR.[JournalofOrganicChemistry,1988,vol.53,#11,p.2639-2642]

[7]Bugaev;Dmitriev;Prosenko[RussianChemicalBulletin,2012,vol.61,#2,p.298-302][Izv.Akad.Nauk,Ser.Khim.,2012,#2,p.297-301,5]

[8]CurrentPatentAssignee:JIANGSUMAIDANEWMAT-CN108250047,2018,ALocationinpatent:Paragraph0029;0030;0033;0036

140-31-8    88-27-7    135330-54-0 

[1]Zagidullin,R.N.[JournalofgeneralchemistryoftheUSSR,1991,vol.61,#1.2,p.225-230][ZhurnalObshcheiKhimii,1991,vol.61,#1,p.247-253]

108-31-6    88-27-7    118-82-1    127900-92-9 

[1]Nikiforov,G.A.;Bannikov,G.F.;Mal'donado,I.K.A.Romero;Malysheva,R.D.;Ershov,V.V.[BulletinoftheAcademyofSciencesoftheUSSRDivisionofChemicalScience,1989,vol.<1>38,#12,p.2530-2535][IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1989,#12,p.2765-2770]

108-30-5    88-27-7    118-82-1    127900-91-8 

[1]Nikiforov,G.A.;Bannikov,G.F.;Mal'donado,I.K.A.Romero;Malysheva,R.D.;Ershov,V.V.[BulletinoftheAcademyofSciencesoftheUSSRDivisionofChemicalScience,1989,vol.<1>38,#12,p.2530-2535][IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1989,#12,p.2765-2770]

1004-38-2    88-27-7   
2,6-Di-tert-butyl-4-(2,4,6-triamino-pyrimidin-5-ylmethyl)-phenol 

[1]JournalofMedicinalChemistry,1980,vol.23,p.535-541

Literature fold

Title: Anaerobic toxicity assay of plasticisers.

Journal: Journal of environmental science and health. Part A, Toxic/hazardous substances & environmental engineering20120101

Title: Discovery of novel SERCA inhibitors by virtual screening of a large compound library.

Journal: European journal of medicinal chemistry20110501

Title: Bis(1,2,2,6,6-penta-methyl-piperidin-4-yl) 2-butyl-2-(3,5-di-tert-butyl-4-hydroxy-benz-yl)malonate (Tinuvin 144).

Journal: Acta crystallographica. Section E, Structure reports online20091001

Title: Dimethyl 2-butyl-2-(3,5-di-tert-butyl-4-hydroxy-benz-yl)malonate.

Journal: Acta crystallographica. Section E, Structure reports online20091001

Title: Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.

Journal: Journal of molecular graphics & modelling20061101

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

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology20060501

Title: Steroid hormone activity of flavonoids and related compounds.

Journal: Breast cancer research and treatment20000701

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