Pemetrexed disodium heptahydrate CRS
Product Code
EPY0001539
CAS Number
Product Format
Neat
Molecular Formula
C20 H19 N5 O6 . 2 Na . 7 H2 O
Molecular Weight
597.48
API Family
Pemetrexed Disodium HeptahydrateProduct Categories
Product Type
APIAlternate CAS Number
Price and availability
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Product Information
Product Data
Analyte Name
Pemetrexed disodium heptahydrate
CAS Number
357166-29-1
Molecular Formula
C20 H19 N5 O6 . 2 Na . 7 H2 O
Molecular Weight
597.48
Accurate Mass
597.187
Flash Point
5.0
SMILES
O.O.O.O.O.O.O.[Na+].[Na+].NC1=NC(=O)c2c(CCc3ccc(cc3)C(=O)N[C@@H](CCC(=O)[O-])C(=O)[O-])c[nH]c2N1
InChI
, , , /p-2/t13-, /h1-2,4-5,9,13H,3,6-8H2,(H,23,28)(H,26,27)(H,30,31)(H4,21,22,24,25,29), , , , , , , InChI=1S/C20H21N5O6.2Na.7H2O/c21-20-24-16-15(18(29)25-20)12(9-22-16)6-3-10-1-4-11(5-2-10)17(28)23-13(19(30)31)7-8-14(26)27, 7*1H2/q, /m0........./s1, , , , , , , , , 2*+1, , , , , , ,
IUPAC
disodium;(2S)-2-[[4-[2-(2-amino-4-oxo-1,7-dihydropyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl]amino]pentanedioate;heptahydrate
Alternate CAS Number
Anhydrous free acid: 137281-23-3
Storage & Transport Information
Storage Temperature
2-8C Fridge/Coldroom
Shipping Temperature
Room Temperature
Country of Origin
FRANCE
Tariff Code
29335995
Product Attributes
Product Type
API
Product Format
Neat
API Family
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