[(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate

CAS: 1094-61-7

Molecular Formula	`C11H15N2O8P`
Molecular Weight	334.22 g/mol
LogP	-3.5
Topological Polar Surface Area	166.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	8
Rotatable Bonds	5
Exact Mass	334.0566
Heavy Atoms	22
Complexity	455.0

Chemical Identifiers

CAS Number	1094-61-7
SMILES	`C1=CC(=C[N+](=C1)C2C(C(C(O2)COP(=O)(O)[O-])O)O)C(=O)N`
InChIKey	`DAYLJWODMCOQEW-TURQNECASA-N`

📖 Product Overview

[(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate (CAS: 1094-61-7) is a chemical compound with molecular formula C11H15N2O8P and molecular weight 334.22 g/mol. Its IUPAC systematic name is [(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate. LogP -3.5 Topological Polar Surface Area 166.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 8 Rotatable Bonds 5 Exact Mass 334.0566 Heavy Atoms 22 Complexity 455.0 InChI Key: DAYLJWODMCOQEW-TURQNECASA-N. SMILES: C1=CC(=C[N+](=C1)C2C(C(C(O2)COP(=O)(O)[O-])O)O)C(=O)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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Technical Blog Article

Multi-source research profile: chemical properties, regulatory status, and sourcing guide for [(2R,3S,4R,5R)-5-(3-carbamoylpyridin-1-ium-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate.

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