12-chloro-3-methyl-3,7,9,11-tetraazatricyclo[6.4.0.0²,⁶]dodeca-1(12),2(6),4,8,10-pentaene CAS 2180983-63-3

Purity 97%+In StockPharmaceutical Standards
CAS No.2180983-63-3
Molecular FormulaC9H17ClN4
Molecular Weight216.71 g/mol
CategoryPharmaceutical Standards / API Standards
AvailabilityIn Stock

Chemical Structure

12-chloro-3-methyl-3,7,9,11-tetraazatricyclo[6.4.0.0²,⁶]dodeca-1(12),2(6),4,8,10-pentaene CAS 2180983-63-3 chemical structure

Description

The occurrence of 12-chloro-3-methyl-3,7,9,11-tetraazatricyclo[6.4.0.0²,⁶]dodeca-1(12),2(6),4,8,10-pentaene is closely related to a nitrile group, chlorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.

12-chloro-3-methyl-3,7,9,11-tetraazatricyclo[6.4.0.0²,⁶]dodeca-1(12),2(6),4,8,10-pentaene (CAS 2180983-63-3) is a high-purity analytical reference standard with the molecular formula C9H17ClN4 and a molecular weight of 216.71 g/mol.

The molecular framework of 12-chloro-3-methyl-3,7,9,11-tetraazatricyclo[6.4.0.0²,⁶]dodeca-1(12),2(6),4,8,10-pentaene (C9H17ClN4) is characterized by a nitrile group, chlorine substitution. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.

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

CATO manufactures 12-chloro-3-methyl-3,7,9,11-tetraazatricyclo[6.4.0.0²,⁶]dodeca-1(12),2(6),4,8,10-pentaene under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.

Physical & Chemical Properties

Molecular FormulaC9H17ClN4
Molecular Weight216.71 g/mol
AppearanceWhite to pale yellow crystalline powder. (slight halide-like odor, faint amine-like odor)
Purity97%+
StorageStore at 2-8°C, protect from light, keep tightly closed to prevent evaporation
Solubility (reference)Soluble in DMSO, DMF, methanol
StabilityMay oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light
Degree of Unsaturation (DBE)3.0
UV AbsorptionUV-absorbing
CAS Registry Year (est.)1998
Halogen ContentCl-containing
Nitrogen Atoms4

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