436798

N⁴-Benzoylcytosine

98%

• Empirical Formula (Hill Notation): C₁₁H₉N₃O₂
• CAS Number: 26661-13-2
• Molecular Weight: 215.21
• NACRES: NA.22
• PubChem Substance ID: 24867302
• UNSPSC Code: 12352100
• MDL number: MFCD00239434
• Assay: 98%

Properties

• Quality Segment: 100
• assay: 98%
• mp: >300 °C (dec.) (lit.)
• functional group: amide, phenyl
• SMILES string: O=C1NC=CC(NC(=O)c2ccccc2)=N1
• InChI: 1S/C11H9N3O2/c15-10(8-4-2-1-3-5-8)13-9-6-7-12-11(16)14-9/h1-7H,(H2,12,13,14,15,16)
• InChI key: XBDUZBHKKUFFRH-UHFFFAOYSA-N

Description

General description

N⁴-Benzoylcytosine is an amide and its anti-microbial activity against pathogenic microorganisms has been studied using the Disk Diffusion and the Pour Plate method. It can be synthesized via the condensation of benzoyl chloride with cytosine.

Application

N⁴-Benzoylcytosine may be employed for the following syntheses:

• 3′-C-ethynyl and 3′-C-(1,4-disubstituted-1,2,3-triazolo) double-headed pyranonucleosides
• 2′-C-methyl-4′-thiocytidine, via the Pummerer reaction
• 2′-fluorinated L-nucleoside analogs

Safety Information

• Pictograms: GHS07
• Signal Word: Warning
• Hazard Codes: H302 + H332,H315,H319,H335
• Precautionary Statements: P261 - P264 - P301 + P312 - P302 + P352 - P304 + P340 + P312 - P305 + P351 + P338
• Hazard Classifications: Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
• Target Organs: Respiratory system
• Storage Class: 11 - Combustible Solids
• WGK: WGK 3
• Flash Point (°F): Not applicable
• Flash Point (°C): Not applicable
• PPE (personal protective equipment): dust mask type N95 (US), Eyeshields, Gloves