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101968-85-8,MFCD12796012
Catalog No.:AA000613

101968-85-8 | (S)-2-(3-(tert-Butyl)ureido)-3,3-dimethylbutanoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$7.00   $5.00
- +
5g
98%
in stock  
$18.00   $13.00
- +
25g
98%
in stock  
$73.00   $51.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000613
Chemical Name:
(S)-2-(3-(tert-Butyl)ureido)-3,3-dimethylbutanoic acid
CAS Number:
101968-85-8
Molecular Formula:
C11H22N2O3
Molecular Weight:
230.3040
MDL Number:
MFCD12796012
SMILES:
O=C(NC(C)(C)C)N[C@@H](C(C)(C)C)C(=O)O
Properties
Computed Properties
 
Complexity:
274  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Rotatable Bond Count:
4  
XLogP3:
1.7  

Downstream Synthesis Route
methyl(1R,2S,5S)-6,6-dimethyl-3-azabicyclo3.1.0hexane-2-carboxylatehydrochloridesalt 
  101968-85-8    394735-27-4 

[1]Bhalerao,DineshS.;Arkala,AnilKumarReddy;Madhavi;Nagaraju;Gade,SrinivasReddy;Kumar,U.K.Syam;Bandichhor,Rakeshwar;Dahanukar,VilasH.[OrganicProcessResearchandDevelopment,2015,vol.19,#11,p.1559-1567]

[2]CurrentPatentAssignee:TEXASA&MUNIVERSITYSYSTEM-WO2022/20711,2022,A1Locationinpatent:Paragraph0495-0497

[3]CurrentPatentAssignee:TEXASA&MUNIVERSITYSYSTEM-WO2022/20711,2022,A1Locationinpatent:Paragraph0495-0497

[4]CurrentPatentAssignee:MERCK&COINC-WO2004/113294,2004,A1Locationinpatent:Page/Pagecolumn20-21

[5]CurrentPatentAssignee:MERCK&COINC-WO2008/79216,2008,A1Locationinpatent:Page/Pagecolumn18-20

[6]CurrentPatentAssignee:MSNLABORATORIESPRIVATELIMITED-WO2014/61034,2014,A1Locationinpatent:Page/Pagecolumn49-50

None 
  101968-85-8   
None 

[1]CurrentPatentAssignee:MERCK&COINC-WO2004/113294,2004,A1Locationinpatent:Page/Pagecolumn25

[1]CurrentPatentAssignee:QUESTDIAGNOSTICSINC-WO2007/5838,2007,A2Locationinpatent:Page/Pagecolumn61

[1]CurrentPatentAssignee:QUESTDIAGNOSTICSINC-WO2007/5838,2007,A2Locationinpatent:Page/Pagecolumn63

Literature
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SDS
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Tags:101968-85-8 Molecular Formula|101968-85-8 MDL|101968-85-8 SMILES|101968-85-8 (S)-2-(3-(tert-Butyl)ureido)-3,3-dimethylbutanoic acid