7-(dihydroxyboranyl)-9,9-dihexylfluoren-2-ylboronic acid

7-(dihydroxyboranyl)-9,9-dihexylfluoren-2-ylboronic acid

CAS: 203927-98-4

Formula: C25H36B2O4

SMILES: CCCCCCC1(CCCCCC)C2=C(C=CC(=C2)B(O)O)C2=C1C=C(C=C2)B(O)O

IUPAC: [7-(dihydroxyboranyl)-9,9-dihexyl-9H-fluoren-2-yl]boronic acid

InChI: InChI=1S/C25H36B2O4/c1-3-5-7-9-15-25(16-10-8-6-4-2)23-17-19(26(28)29)11-13-21(23)22-14-12-20(27(30)31)18-24(22)25/h11-14,17-18,28-31H,3-10,15-16H2,1-2H3

Composition: C (71.13%), H (8.60%), B (5.12%), O (15.16%)

Molar Mass: 422.18

Atom Count: 67

Heavy Atom Count: 31

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	422.27997
Formal Charge	0
FSP3	0.52
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	4
InChIKey	QFWOJNOZWMHNTK-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	129.49
Topological Polar Surface Area	80.92
Polarizability	50.88
Ring Count	3
Rotatable Bond Count	12

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	203927-98-4		$28.05-$355.30$28.05$78.54$355.30