Estradiol Hemihydrate
Product Code
MM0300.00-0250
CAS Number
EP Description
Estradiol Benzoate Impurity A as Hemihydrate, Estradiol Valerate Impurity A as Hemihydrate, Estriol Impurity D as Hemihydate, Ethinylestradiol Impurity D as Hemihydrate
Product Format
Neat
Molecular Formula
2 C18 H24 O2 . H2 O
Molecular Weight
562.78
Product Categories
API Reference Standards & Research Materials, Impurity Reference Materials , Hormones, Mikromol
Drug Type
Sex Hormones
Price and availability
Documentation
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Product Information
Product Data
Analyte Name
Estradiol Hemihydrate
CAS Number
35380-71-3
Molecular Formula
2 C18 H24 O2 . H2 O
Molecular Weight
562.78
Accurate Mass
562.3658
SMILES
O.C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CC[C@@H]2O.C[C@]56CC[C@H]7[C@@H](CCc8cc(O)ccc78)[C@@H]5CC[C@@H]6O
InChI
/h2*3,5,10,14-17,19-20H,2,4,6-9H2,1H3, 1H2/t2*14-,15-,16+,17+,18+, InChI=1S/2C18H24O2.H2O/c2*1-18-9-8-14-13-5-3-12(19)10-11(13)2-4-15(14)16(18)6-7-17(18)20, /m11./s1
IUPAC
(8R,9S,13S,14S,17S)-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol;hydrate
Storage & Transport Information
Storage Temperature
+5°C
Shipping Temperature
Room Temperature
Country of Origin
GERMANY
Product Attributes
Product Type
API; Impurity
Product Format
Neat
Impurity Type
Degradation Product; Intermediate
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