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

Catalog Number	ACM65355080-3
CAS	65355-08-0
Structure
Synonyms	(R)-(+)-3,3'-Dibromo-5,5',6,6',7,7',8,8'-octahydro-1,1'-bi-2,2'-naphthalenediol
IUPAC Name	3-bromo-1-(3-bromo-2-hydroxy-5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydronaphthalen-2-ol
Molecular Weight	452.20
Molecular Formula	C20H20Br2O2
Canonical SMILES	C1CCC2=C(C(=C(C=C2C1)Br)O)C3=C4CCCCC4=CC(=C3O)Br
InChI	WDRTXCNGVVLRSZ-UHFFFAOYSA-N
InChI Key	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
Boiling Point	507.3±50.0 °C(Predicted)
Melting Point	146-149 °C
Purity	98%+
Density	1.628 g/cm3
Appearance	Solid
Exact Mass	451.98096
Heavy Atom Count	24
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
Isomeric SMILES	C1CCC2=C(C(=C(C=C2C1)Br)O)C3=C4CCCCC4=CC(=C3O)Br
Monoisotopic Mass	451.98096
Optical Purity	≥99%e.e.
Rotatable Bond Count	1
Specific Rotation	+53°, (c=1 in tetrahydrofuran)
Topological Polar Surface Area	40.5 Ų