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173991-06-5,MFCD06801749
Catalog No.:AA00AKI2

173991-06-5 | 4'-(Dimethylamino)[1,1'-biphenyl]-4-carbaldehyde

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$57.00   $40.00
- +
250mg
95%
in stock  
$95.00   $67.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00AKI2
Chemical Name:
4'-(Dimethylamino)[1,1'-biphenyl]-4-carbaldehyde
CAS Number:
173991-06-5
Molecular Formula:
C15H15NO
Molecular Weight:
225.2857
MDL Number:
MFCD06801749
SMILES:
O=Cc1ccc(cc1)c1ccc(cc1)N(C)C
Properties
Computed Properties
 
Complexity:
235  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.4  

Downstream Synthesis Route

[1]Tanaka,Akira;Terasawa,Takeshi;Hagihara,Hiroyuki;Sakuma,Yuri;Ishibe,Noriko;Sawada,Masae;Takasugi,Hisashi;Tanaka,Hirokazu[BioorganicandMedicinalChemistry,1998,vol.6,#1,p.15-30]

[1]CurrentPatentAssignee:METACRINEINC-WO2017/49172,2017,A1Locationinpatent:Paragraph00391

[2]CurrentPatentAssignee:METACRINEINC-WO2017/49177,2017,A1Locationinpatent:Paragraph0383

[3]Hu,Qingzhong;Negri,Matthias;Jahn-Hoffmann,Kerstin;Zhuang,Yan;Olgen,Sureyya;Bartels,Marc;Mueller-Vieira,Ursula;Lauterbach,Thomas;Hartmann,RolfW.[BioorganicandMedicinalChemistry,2008,vol.16,#16,p.7715-7727]

[4]CurrentPatentAssignee:METACRINEINC-WO2017/49173,2017,A1Locationinpatent:Paragraph00427

[1]NewJournalofChemistry,2013,vol.37,p.4230-4240

[1]Tetrahedron,2014,vol.70,p.7551-7559

Literature
Quotation Request
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SDS
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Tags:173991-06-5 Molecular Formula|173991-06-5 MDL|173991-06-5 SMILES|173991-06-5 4'-(Dimethylamino)[1,1'-biphenyl]-4-carbaldehyde
Catalog No.: AA00AKI2
173991-06-5,MFCD06801749
173991-06-5 | 4'-(Dimethylamino)[1,1'-biphenyl]-4-carbaldehyde
Pack Size： 100mg
Purity： 95%
in stock
$57.00 $40.00
Pack Size： 250mg
Purity： 95%
in stock
$95.00 $67.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00AKI2
Chemical Name: 4'-(Dimethylamino)[1,1'-biphenyl]-4-carbaldehyde
CAS Number: 173991-06-5
Molecular Formula: C15H15NO
Molecular Weight: 225.2857
MDL Number: MFCD06801749
SMILES: O=Cc1ccc(cc1)c1ccc(cc1)N(C)C
Properties
Complexity: 235  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 17  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.4  
Downstream Synthesis Route
179055-26-6    173991-06-5 

[1]Tanaka,Akira;Terasawa,Takeshi;Hagihara,Hiroyuki;Sakuma,Yuri;Ishibe,Noriko;Sawada,Masae;Takasugi,Hisashi;Tanaka,Hirokazu[BioorganicandMedicinalChemistry,1998,vol.6,#1,p.15-30]

586-77-6    87199-17-5    173991-06-5 

[1]CurrentPatentAssignee:METACRINEINC-WO2017/49172,2017,A1Locationinpatent:Paragraph00391

[2]CurrentPatentAssignee:METACRINEINC-WO2017/49177,2017,A1Locationinpatent:Paragraph0383

[3]Hu,Qingzhong;Negri,Matthias;Jahn-Hoffmann,Kerstin;Zhuang,Yan;Olgen,Sureyya;Bartels,Marc;Mueller-Vieira,Ursula;Lauterbach,Thomas;Hartmann,RolfW.[BioorganicandMedicinalChemistry,2008,vol.16,#16,p.7715-7727]

[4]CurrentPatentAssignee:METACRINEINC-WO2017/49173,2017,A1Locationinpatent:Paragraph00427

15164-44-0    171364-78-6    173991-06-5 

[1]NewJournalofChemistry,2013,vol.37,p.4230-4240

1122-91-4    171364-78-6    173991-06-5 

[1]Tetrahedron,2014,vol.70,p.7551-7559

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