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About This Item

Empirical Formula (Hill Notation):
C11H9N3O2
CAS Number:
Molecular Weight:
215.21
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Quality Level

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

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

pictograms

Exclamation mark

signalword

Warning

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_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves


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