5-Isothiocyanato-2-methoxy-4,6-dimethyl-pyrimidine CAS 1173984-11-6

Purity 97%+In StockPharmaceutical Standards
CAS No.1173984-11-6
Molecular FormulaC8H9N3OS
Molecular Weight195.24 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

5-Isothiocyanato-2-methoxy-4,6-dimethyl-pyrimidine CAS 1173984-11-6 chemical structure

Description

The occurrence of 5-Isothiocyanato-2-methoxy-4,6-dimethyl-pyrimidine is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

5-Isothiocyanato-2-methoxy-4,6-dimethyl-pyrimidine (CAS 1173984-11-6) is a high-purity analytical reference standard with the molecular formula C8H9N3OS and a molecular weight of 195.24 g/mol.

Structurally, 5-Isothiocyanato-2-methoxy-4,6-dimethyl-pyrimidine (C8H9N3OS) contains a nitrogen-containing heterocyclic scaffold, an amide group, sulfur-containing functionality, a hydroxyl group, an ether linkage. The molecule exhibits a degree of unsaturation (DBE) of 6.0, corresponding to approximately 6 ring(s) or double-bond equivalent(s). With a molecular weight of 195.24 g/mol, it falls into the medium-molecular-weight range. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.

Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.

The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.

Physical & Chemical Properties

Molecular FormulaC8H9N3OS
Molecular Weight195.24 g/mol
Purity97%+
StorageStore at 2-8°C, protect from light
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityLight-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)6.0
UV AbsorptionUV-absorbing
Structural FeaturesAromatic ring present
CAS Registry Year (est.)1989
Nitrogen Atoms3
Sulfur Atoms1

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