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ChemicalBook--->CAS DataBase List--->1130115-44-4

1130115-44-4

1130115-44-4 Structure

1130115-44-4 Structure
IdentificationBack Directory
[Name]

Sorafenib-d3
[CAS]

1130115-44-4
[Synonyms]

[2H3]-Sorafenib
Donafenib Tosylate
SORAFENIB D3 (BAY 43-9006 D3)
4-[4-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]phenoxy]-N-(trideuteriomethyl)pyridine-2-carboxamide
[Molecular Formula]

C21H16ClF3N4O3
[MDL Number]

MFCD08460931
[MOL File]

1130115-44-4.mol
[Molecular Weight]

464.825
Chemical PropertiesBack Directory
[Melting point ]

202-204?C
[storage temp. ]

-20°C Freezer
[solubility ]

DMSO: soluble; Methanol: soluble
[form ]

A solid
[color ]

White to off-white
[InChI]

InChI=1S/C21H16ClF3N4O3/c1-26-19(30)18-11-15(8-9-27-18)32-14-5-2-12(3-6-14)28-20(31)29-13-4-7-17(22)16(10-13)21(23,24)25/h2-11H,1H3,(H,26,30)(H2,28,29,31)
[InChIKey]

MLDQJTXFUGDVEO-UHFFFAOYSA-N
[SMILES]

c1(Cl)ccc(NC(Nc2ccc(Oc3ccnc(C(=O)NC)c3)cc2)=O)cc1C(F)(F)F
Hazard InformationBack Directory
[Chemical Properties]

Off-White to Light Pink Solid
[Uses]

Labelled Sorafenib, a potent RAF kinase inhibitor. Antineoplastic.
Spectrum DetailBack Directory
[Spectrum Detail]

Sorafenib-d3(1130115-44-4)1HNMR
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