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676-49-3

676-49-3 Structure

676-49-3 Structure
IdentificationBack Directory
[Name]

METHANE (D1)
[CAS]

676-49-3
[Synonyms]

BL 194
METHANE-D
METHANE (D1)
deuteriomethane
Methane-D1 (gas)
METHANE (D1, 98%)
Penthydroxyfylline
monodeuteriomethane
Pentoxifylline Alcohol
METHANE-D, 98 ATOM % D
1-(5-Hydroxyhexyl)theobromine
3,7-Dimethyl-1-(5-hydroxyhexyl)xanthine
[Molecular Formula]

CH3D
[MDL Number]

MFCD00084153
[MOL File]

676-49-3.mol
[Molecular Weight]

17.05
Chemical PropertiesBack Directory
[Appearance]

White Solid
[Melting point ]

−183 °C(lit.)
[Boiling point ]

−161 °C(lit.)
[Fp ]

-188℃
[Stability:]

Stable. Highly flammable. Incompatible with strong oxidizing agents, halogens.
[InChI]

InChI=1S/CH4/h1H4/i1D
[InChIKey]

VNWKTOKETHGBQD-MICDWDOJSA-N
[SMILES]

C[2H]
[CAS Number Unlabeled]

74-82-8
Hazard InformationBack Directory
[Chemical Properties]

White Solid
[Uses]

A major oxidative metabolite of Pentoxifylline. A potent inhibitor of phosphatidic acid generation (IC50=0.6uM). Protects mice from endotoxic shock and attenuates sepsis-induced acute lung injury in pig
Safety DataBack Directory
[Hazard Codes ]

F+
[Risk Statements ]

12
[Safety Statements ]

16-38-33-9
[RIDADR ]

UN 1971 2.1
[WGK Germany ]

3
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