4-{3-hydroxy-5,6,7,8-tetrahydro-[2,2'-binaphthalen]-4-yl}-5,6,7,8-tetrahydro-[2,2'-binaphthalen]-3-ol

4-{3-hydroxy-5,6,7,8-tetrahydro-[2,2'-binaphthalen]-4-yl}-5,6,7,8-tetrahydro-[2,2'-binaphthalen]-3-ol

CAS: 922711-77-1

Formula: C40H34O2

SMILES: OC1=C(C=C2CCCCC2=C1C1=C2CCCCC2=CC(=C1O)C1=CC2=CC=CC=C2C=C1)C1=CC2=CC=CC=C2C=C1

IUPAC: 4-{3-hydroxy-5,6,7,8-tetrahydro-[2,2'-binaphthalen]-4-yl}-5,6,7,8-tetrahydro-[2,2'-binaphthalen]-3-ol

InChI: InChI=1S/C40H34O2/c41-39-35(31-19-17-25-9-1-3-11-27(25)21-31)23-29-13-5-7-15-33(29)37(39)38-34-16-8-6-14-30(34)24-36(40(38)42)32-20-18-26-10-2-4-12-28(26)22-32/h1-4,9-12,17-24,41-42H,5-8,13-16H2

Composition: C (87.88%), H (6.27%), O (5.85%)

Molar Mass: 546.71

Atom Count: 76

Heavy Atom Count: 42

Properties

Properties

Common Names	N/A
Aromatic Ring Count	6
Asymmetric Atom Count	0
Exact Mass	546.255880335
Formal Charge	0
FSP3	0.2
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	PDVXDTYPKYBDSR-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	173.29
Topological Polar Surface Area	40.46
Polarizability	72.97
Ring Count	8
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
99%	<5 Days	922711-77-1		$123.58-$358.12$123.58$192.93$358.12