4-CyanoBenzoic acid

CAS:
Other names: Benzoic acid, p-cyano-; p-Carboxybenzonitrile; p-Cyanobenzoic acid; 4-Cyanobenzoic acid; Terephthalic mononitrile; 4-Carboxybenzonitrile
SMILES: OC(=O)c1ccc(cc1)C#N

Properties

MW HBA HBD LogP TPSA Rot. Comp. Fsp3C Brutto formula
147.13 3 1 1.26 61.089999999999996 1 34 0.00 C8H5NO2

Availability

Suppliers Supplier IDs Storage Storage ID Quantity Class Added
nt0218 None Jan. 1, 2023

Bar codes

Plate barcode Sample barcode

PAINS

Identified PAINS
Not checked

Supramolecules

Namelog KSDpHT(°C)MethodRef
[a-Cyclodextrin](1).[4-CyanoBenzoic acid] 2.64 25.0 Kenneth A. Connors 1995
Comment