3-CyanoBenzoic acid anion

CAS:
Other names:
SMILES: O=C([O-])C1=CC=CC(C#N)=C1

Properties

MW HBA HBD LogP TPSA Rot. Comp. Fsp3C Brutto formula
146.12 2 0 -0.08 63.919999999999995 1 37 0.00 C8H4NO2-

Availability

Suppliers Supplier IDs Storage Storage ID Quantity Class Added
nt0217 None Jan. 1, 2023

Bar codes

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PAINS

Identified PAINS
Not checked

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[3-CyanoBenzoic acid anion] 1.78 25.0 Kenneth A. Connors 1995
Comment