6-Chloro-7-deazapurine, 98%

Description

CAS: 3680-69-1 | C6H4ClN3 | 153.569 g/mol

6-Chloro-7-deazapurine is used for making tofacitinib.

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Applications
6-Chloro-7-deazapurine is used for making tofacitinib.

Solubility
Soluble in DMSO, ethyl acetate and methanol.

Notes
Store in cool, dry place in a well sealed container. Store away from oxidizing agents.

Specifications

Chemical Identifiers

• CAS: 3680-69-1
• Molecular Formula: C6H4ClN3
• Molecular Weight (g/mol): 153.569
• MDL Number: MFCD01686865
• InChI Key: BPTCCCTWWAUJRK-UHFFFAOYSA-N
• Synonym: 4-chloro-7h-pyrrolo 2,3-d pyrimidine, 4-chloropyrrolo 2,3-d pyrimidine, 6-chloro-7-deazapurine, 4-chloro-1h-pyrrolo 2,3-d pyrimidine, 7h-pyrrolo 2,3-d pyrimidine, 4-chloro, 1h-pyrrolo 2,3-d pyrimidine, 4-chloro, 6-chloro-7-deazapurine 4-chloro-1h-pyrrolo 2,3-d pyrimidine, 4-chloro-1h-pyrrol 2,3-d pyrimidine
• PubChem CID: 5356682
• IUPAC Name: 4-chloro-7H-pyrrolo[2,3-d]pyrimidine
• SMILES: C1=CNC2=C1C(=NC=N2)Cl

• Melting Point: 190°C to 192°C
• Quantity: 1 g
• Solubility Information: Soluble in DMSO,ethyl acetate and methanol.
• Formula Weight: 153.52
• Percent Purity: 98%
• Chemical Name or Material: 6-Chloro-7-deazapurine

Safety and Handling

Hazard Category	H315-H319-H335
Hazard Statement	GHS H Statement H315-H319-H335 Causes skin irritation. Causes serious eye irritation. May cause respiratory irritation.
Precautionary Statement	P261-P264b-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P332+P313-P362-P501c
TSCA	No
Recommended Storage	Keep cold

SDS

RUO – Research Use Only