Home Halogens (S)-3,3'-Dibromo-5,5',6,6',7,7',8,8'-octahydro-[1,1'-binaphthalene]-2,2'-diol

(S)-3,3'-Dibromo-5,5',6,6',7,7',8,8'-octahydro-[1,1'-binaphthalene]-2,2'-diol

CAS No.:
765278-73-7
Catalog Number:
AG003CDU
Molecular Formula:
C20H20Br2O2S
Molecular Weight:
484.2446
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>97.0%(GC)
1 week
United States
$332
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Product Description
Catalog Number:
AG003CDU
Chemical Name:
(S)-3,3'-Dibromo-5,5',6,6',7,7',8,8'-octahydro-[1,1'-binaphthalene]-2,2'-diol
CAS Number:
765278-73-7
Molecular Formula:
C20H20Br2O2S
Molecular Weight:
484.2446
MDL Number:
MFCD03093977
IUPAC Name:
3-bromo-1-(3-bromo-2-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol
InChI:
InChI=1S/C20H20Br2O2/c21-15-9-11-5-1-3-7-13(11)17(19(15)23)18-14-8-4-2-6-12(14)10-16(22)20(18)24/h9-10,23-24H,1-8H2
InChI Key:
WDRTXCNGVVLRSZ-UHFFFAOYSA-N
SMILES:
Brc1cc2CCCCc2c(c1O)c1c(O)c(Br)cc2c1CCCC2.[S]
Properties
Complexity:
405  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
451.981g/mol
Formal Charge:
0
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
452.186g/mol
Monoisotopic Mass:
449.983g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7  
Literature
Title Journal
PBDE: structure-activity studies for the inhibition of hepatitis C virus NS3 helicase. Molecules (Basel, Switzerland) 20140402
Synthesis of novel monodentate phosphoramidites and their application in iridium-catalyzed asymmetric hydrogenations. Chemistry, an Asian journal 20080505
Properties