ISONICOTINAMIDE, N-(3-DIFLUOROMETHOXYPHENYL)-, HYDROCHLORIDE

[3-(difluoromethoxy)phenyl]-(pyridine-4-carbonyl)azanium chloride

CAS: 54231-56-0

Molecular Formula	`C13H11ClF2N2O2`
Molecular Weight	300.69 g/mol
Topological Polar Surface Area	55.8 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	4
Exact Mass	300.0477
Heavy Atoms	20
Complexity	296.0

Chemical Identifiers

CAS Number	54231-56-0
SMILES	`C1=CC(=CC(=C1)OC(F)F)[NH2+]C(=O)C2=CC=NC=C2.[Cl-]`
InChIKey	`DRCWKSLSPAENOZ-UHFFFAOYSA-N`

📖 Product Overview

ISONICOTINAMIDE, N-(3-DIFLUOROMETHOXYPHENYL)-, HYDROCHLORIDE (CAS: 54231-56-0) is a chemical compound with molecular formula C13H11ClF2N2O2 and molecular weight 300.69 g/mol. Its IUPAC systematic name is [3-(difluoromethoxy)phenyl]-(pyridine-4-carbonyl)azanium chloride. Topological Polar Surface Area 55.8 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 6 Rotatable Bonds 4 Exact Mass 300.0477 Heavy Atoms 20 Complexity 296.0 InChI Key: DRCWKSLSPAENOZ-UHFFFAOYSA-N. SMILES: C1=CC(=CC(=C1)OC(F)F)[NH2+]C(=O)C2=CC=NC=C2.[Cl-].

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