heptan-2-one

CAS:
Other names:
SMILES: CCCCCC(C)=O

Properties

MW HBA HBD LogP TPSA Rot. Comp. Fsp3C Brutto formula
114.19 1 0 2.16 17.07 4 12 0.86 C7H14O

Availability

Suppliers Supplier IDs Storage Storage ID Quantity Class Added
JN_267 None Jan. 1, 2023

Bar codes

Plate barcode Sample barcode

PAINS

Identified PAINS
Not checked

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[heptan-2-one] 2.55 0.71 11.6 25.0 inhibition kinetics method, stopped-flow spectroscopy Oswald S.Tee 1996
[b-Cyclodextrin](1).[heptan-2-one] 2.32 0.97 11.6 25.0 inhibition kinetics method, stopped-flow spectroscopy Oswald S.Tee 1996
[b-Cyclodextrin](1).[heptan-2-one] 2.31 1.31 25.0 fluorescent probe method Oswald S.Tee 1996
[2-O-(2-Hydroxy)propyl-b-Cyclodextrin](1).[heptan-2-one] 2.18 -0.16 11.6 25.0 inhibition kinetics method, stopped-flow spectroscopy Oswald S.Tee 1996
Comment