Cyanothymidine

(2S,3R,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolane-3-carbonitrile

CAS: 116195-58-5

Molecular Formula	`C11H13N3O4`
Molecular Weight	251.24 g/mol
LogP	-1.2
Topological Polar Surface Area	103.0 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	2
Exact Mass	251.0906
Heavy Atoms	18
Complexity	464.0

Chemical Identifiers

CAS Number	116195-58-5
SMILES	`CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)C#N`
InChIKey	`LFAIUPXHKWZRNL-IWSPIJDZSA-N`

📖 Product Overview

Cyanothymidine (CAS: 116195-58-5) is a chemical compound with molecular formula C11H13N3O4 and molecular weight 251.24 g/mol. Its IUPAC systematic name is (2S,3R,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolane-3-carbonitrile. LogP -1.2 Topological Polar Surface Area 103.0 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 2 Exact Mass 251.0906 Heavy Atoms 18 Complexity 464.0 InChI Key: LFAIUPXHKWZRNL-IWSPIJDZSA-N. SMILES: CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)C#N.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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What documentation do you provide with the product?

We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

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