3-{[(4-chlorophenyl)methyl]sulfanyl}-6-phenylpyridazine-4-carbonitrile CAS 338417-86-0

Purity 97%+In StockPharmaceutical Standards
CAS No.338417-86-0
Molecular FormulaC18H12ClN3S
Molecular Weight337.83 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

3-{[(4-chlorophenyl)methyl]sulfanyl}-6-phenylpyridazine-4-carbonitrile CAS 338417-86-0 chemical structure

Description

Compared with other compounds in its class, the molecular weight of 337.83 g/mol gives 3-{[(4-chlorophenyl)methyl]sulfanyl}-6-phenylpyridazine-4-carbonitrile distinctive chromatographic separation conditions and mass-spectrometry parameter settings.

3-{[(4-chlorophenyl)methyl]sulfanyl}-6-phenylpyridazine-4-carbonitrile (CAS 338417-86-0) is a high-purity analytical reference standard with the molecular formula C18H12ClN3S and a molecular weight of 337.83 g/mol.

Structurally, 3-{[(4-chlorophenyl)methyl]sulfanyl}-6-phenylpyridazine-4-carbonitrile (C18H12ClN3S) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, chlorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 14.0, corresponding to approximately 14 ring(s) or double-bond equivalent(s). With a molecular weight of 337.83 g/mol, it falls into the moderately-high-molecular-weight range. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.

This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.

As a certified reference material (CRM), 3-{[(4-chlorophenyl)methyl]sulfanyl}-6-phenylpyridazine-4-carbonitrile meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.

Physical & Chemical Properties

Molecular FormulaC18H12ClN3S
Molecular Weight337.83 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)14.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)2025
Halogen ContentCl-containing
Nitrogen Atoms3
Sulfur Atoms1

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