ChemicalBook--->CAS DataBase List--->104227-88-5

104227-88-5

104227-88-5 Structure

104227-88-5 Structure
IdentificationBack Directory
[Name]

MONO-DESACETYL FAMCICLOVIR
[CAS]

104227-88-5
[Synonyms]

BRL 43594
Famciclovir USP RC B
MONO-DESACETYL FAMCICLOVIR
6-Deoxypenciclovir Acetate
Fanciclovir USP Impurity B
FaMciclovir Related CoMpound B
Famciclovir USP Related Compound B
Penciclovir Acetate 6-Deoxy Impurity
Desacetyl Famciclovir (Famciclovir Related Compound B)
4-(2-Amino-9H-purin-9-yl)-2-(hydroxymethyl)butyl acetate
2-[2-(2-AMino-9H-purin-9-yl)ethyl]-1,3-propanediol 1-Acetate
1,3-Propanediol, 2-[2-(2-amino-9H-purin-9-yl)ethyl]-, 1-acetate
2-[2-(2-Amino-9H-purin-9-yl)ethyl]-1,3-propanediol monoacetate (ester)
Famciclovir Related Compound B (6-Deoxypenciclovir Acetate/ Desacetyl Famciclovir)
Famciclovir Related Compound B (20 mg) [4-(2-Amino-9H-purin-9-yl)-2-(hydroxymethyl)butyl acetate]
Famciclovir Related Compound B [4-(2-Amino-9H-purin-9-yl)-2-(hydroxymethyl)butyl acetate] (1269185)
[Molecular Formula]

C12H17N5O3
[MDL Number]

MFCD08063728
[MOL File]

104227-88-5.mol
[Molecular Weight]

279.3
Chemical PropertiesBack Directory
[Melting point ]

166-168℃
[Boiling point ]

525.0±60.0 °C(Predicted)
[density ]

1.46±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C
[solubility ]

DMSO (Slightly, Heated), Methanol (Slightly, Heated, Sonicated)
[form ]

neat
[pka]

14.62±0.10(Predicted)
[Stability:]

Hygroscopic
[Major Application]

pharmaceutical (small molecule)
[InChI]

InChI=1S/C12H17N5O3/c1-8(19)20-6-9(5-18)2-3-17-7-15-10-4-14-12(13)16-11(10)17/h4,7,9,18H,2-3,5-6H2,1H3,(H2,13,14,16)
[InChIKey]

OUMGIMAEASXOJH-UHFFFAOYSA-N
[SMILES]

C(N1C=NC2=CN=C(N=C12)N)CC(CO)COC(=O)C
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P280-P301+P312-P302+P352-P305+P351+P338
[WGK Germany ]

WGK 3
[HS Code ]

2933599550
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Chemical Properties]

White Solid
[Uses]

A metabolite of Famciclovir (F101125).
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