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4-Heptyl-4'-carboxybiphenyl

CAS No.:
58573-94-7
Catalog Number:
AG003K4N
Molecular Formula:
Molecular Weight:
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
>95.0%(GC)
1 week
United States
$230
- +
Product Description
Catalog Number:
AG003K4N
Chemical Name:
4-Heptyl-4'-carboxybiphenyl
CAS Number:
58573-94-7
MDL Number:
MFCD00143231
IUPAC Name:
4-(4-heptylphenyl)benzoic acid
InChI:
InChI=1S/C20H24O2/c1-2-3-4-5-6-7-16-8-10-17(11-9-16)18-12-14-19(15-13-18)20(21)22/h8-15H,2-7H2,1H3,(H,21,22)
InChI Key:
XVROSBHWACAQRL-UHFFFAOYSA-N
Properties
Complexity:
310  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.178g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
296.41g/mol
Monoisotopic Mass:
296.178g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
37.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.2  
Literature
Title Journal
Design, synthesis, and structure-activity analysis of isoform-selective retinoic acid receptor beta ligands. Journal of medicinal chemistry 20090326
Discovery of a potent, orally available, and isoform-selective retinoic acid beta2 receptor agonist. Journal of medicinal chemistry 20051201
Properties