Compound C9H13O6PS

2-(dimethoxyphosphorylsulfanylmethyl)-5-methoxypyran-4-one

CAS: 2778-04-3

Molecular Formula	`C9H13O6PS`
Molecular Weight	280.24 g/mol
LogP	-0.2
Topological Polar Surface Area	96.4 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	7
Rotatable Bonds	6
Exact Mass	280.01706
Heavy Atoms	17
Complexity	394.0

Chemical Identifiers

CAS Number	2778-04-3
SMILES	`COC1=COC(=CC1=O)CSP(=O)(OC)OC`
InChIKey	`YCAGGFXSFQFVQL-UHFFFAOYSA-N`

📖 Product Overview

Compound C9H13O6PS (CAS: 2778-04-3) is a chemical compound with molecular formula C9H13O6PS and molecular weight 280.24 g/mol. Its IUPAC systematic name is 2-(dimethoxyphosphorylsulfanylmethyl)-5-methoxypyran-4-one. LogP -0.2 Topological Polar Surface Area 96.4 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 7 Rotatable Bonds 6 Exact Mass 280.01706 Heavy Atoms 17 Complexity 394.0 InChI Key: YCAGGFXSFQFVQL-UHFFFAOYSA-N. SMILES: COC1=COC(=CC1=O)CSP(=O)(OC)OC.

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