6-(4-tert-butylanilino)-naphtalene-2-sulfonate

CAS:
Other names: BNS
SMILES: O=S(C1=CC=C2C=C(NC3=CC=C(C(C)(C)C)C=C3)C=CC2=C1)([O-])=O

Properties

MW HBA HBD LogP TPSA Rot. Comp. Fsp3C Brutto formula
354.44 3 1 5.94 77.61000000000001 4 55 0.20 C20H20NO3S-

Availability

Suppliers Supplier IDs Storage Storage ID Quantity Class Added
NT_b0114 None Jan. 1, 2023

Bar codes

Plate barcode Sample barcode

PAINS

Identified PAINS
Not checked

Supramolecules

Namelog KSDpHT(°C)MethodRef
[(b-CD)-S-(CH2)2-S-(b-CD)](1).[6-(4-tert-butylanilino)-naphtalene-2-sulfonate] 6.91 7.0 25.0 fluorescence spectroscopy Lincoln, Stephen F. 1996
[(b-CD)-S-(CH2)6-S-(b-CD)](1).[6-(4-tert-butylanilino)-naphtalene-2-sulfonate] 5.18 7.0 25.0 fluorescence spectroscopy Lincoln, Stephen F. 1996
[(b-CD)-S-S-(b-CD)](1).[6-(4-tert-butylanilino)-naphtalene-2-sulfonate] 4.90 7.0 25.0 fluorescence spectroscopy Lincoln, Stephen F. 1996
Comment