ChemicalBook--->CAS DataBase List--->122111-05-1

122111-05-1

122111-05-1 Structure

122111-05-1 Structure
IdentificationBack Directory
[Name]

4-Amino-1-(2-deoxy-2,2-difluoro-a-D-erythro-pentofuranosyl)-2(1H)-pyrimidinone Hydrochloride
[CAS]

122111-05-1
[Synonyms]

1’-Epi Gemcitabine Hydrochloride
Gemcitabine (alpha-Isomer) Hydrochloride
4-Amino-1-(2-deoxy-2,2-difluoro-a-D-erythro-pentofuranosyl)-2(1H)-pyrimidinone Hydrochloride
4-AMino-1-(2-deoxy-2,2-difluoro-α-D-erythro-pentofuranosyl)-2(1H)-pyriMidinone Hydrochloride
[Molecular Formula]

C9H11F2N3O4.ClH
[MDL Number]

MFCD12031367
[MOL File]

122111-05-1.mol
[Molecular Weight]

299.66
Chemical PropertiesBack Directory
[Appearance]

Pale-Yellow Solid
[Melting point ]

204-206°C
[storage temp. ]

-20°C Freezer, Under Inert Atmosphere
[solubility ]

Methanol (Slightly), Water (Slightly)
[form ]

Solid
[color ]

White to Light Beige
[InChI]

InChI=1/C9H11F2N3O4.ClH/c10-9(11)6(16)4(3-15)18-7(9)14-2-1-5(12)13-8(14)17;/h1-2,4,6-7,15-16H,3H2,(H2,12,13,17);1H/t4-,6-,7+;/s3
[InChIKey]

OKKDEIYWILRZIA-CSHRGNMENA-N
[SMILES]

FC1([C@@H]([C@@H](CO)O[C@@H]1N1C=CC(N)=NC1=O)O)F.Cl |&1:2,3,7,r|
[CAS DataBase Reference]

122111-05-1
Hazard InformationBack Directory
[Chemical Properties]

Pale-Yellow Solid
[Uses]

a-Anomer of Gemcitabine
[Uses]

α-Anomer of Gemcitabine.
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