Product Code

TRC-G305035

CAS Number

2174019-90-8

Product Format

Neat

Molecular Formula

C16 H15 F2 N3 O5

Molecular Weight

367.304

Product Categories

TRC, Pharmaceutical Toxicology Reference Materials , API Reference Standards & Research Materials

Product Type

API

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Gemcitabine 5-Benzoate

CAS Number

2174019-90-8

Molecular Formula

C16 H15 F2 N3 O5

Molecular Weight

367.304

Accurate Mass

367.098

SMILES

NC1=NC(=O)N(C=C1)[C@@H]2O[C@H](COC(=O)c3ccccc3)[C@@H](O)C2(F)F

InChI

InChI=1S/C16H15F2N3O5/c17-16(18)12(22)10(8-25-13(23)9-4-2-1-3-5-9)26-14(16)21-7-6-11(19)20-15(21)24/h1-7,10,12,14,22H,8H2,(H2,19,20,24)/t10-,12-,14-/m1/s1

IUPAC

[(2R,3R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4,4-difluoro-3-hydroxyoxolan-2-yl]methyl benzoate

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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Gemcitabine 5-Benzoate

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