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70-00-8

70-00-8 structural image
Product Name: Trifluridine
Formula: C10H11F3N2O5
Synonyms: α,α,α-Trifluorothymidine;2′-Deoxy-5-trifluoromethyluridine;Trifluorothymidine;Trifluorothymine deoxyriboside;Trifluridine
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Solid
Color/Form Crystals from ethyl acetate
Melting Point 186-189
Solubility >44.4 [ug/mL] (The mean of the results at pH 7.4)
LogP -0.46
Decomposition When heated to decomposition, material emits toxic fumes of /hydrogen fluoride/ and /nitrogen oxides/.
Dissociation Constants 7.95

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Health Hazard
GHS08
GHS Hazard Statements H341:Germ cell mutagenicity
H351:Carcinogenicity
Precautionary Statement Codes P201:Obtain special instructions before use.
P202:Do not handle until all safety precautions have been read and understood.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P308+P313:IF exposed or concerned: Get medical advice/attention.
P405:Store locked up.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 296.20 g/mol
XLogP3 -0.5
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 2
Exact Mass 296.06200594 g/mol
Monoisotopic Mass 296.06200594 g/mol
Topological Polar Surface Area 99.1 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 464
Isotope Atom Count 0
Defined Atom Stereocenter Count 3
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Trifluridine is a pyrimidine 2'-deoxyribonucleoside compound having 5-trifluoromethyluracil as the nucleobase. An antiviral drug used mainly in the treatment of primary keratoconjunctivitis and recurrent epithelial keratitis. It has a role as an antiviral drug, an antimetabolite, an EC 2.1.1.45 (thymidylate synthase) inhibitor and an antineoplastic agent. It is a nucleoside analogue, an organofluorine compound and a pyrimidine 2'-deoxyribonucleoside.

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