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(8r,9s,10r,13s,14s,17r)-13-Ethyl-17-Ethynyl-3-Hydroxyimino-1,2,6,7,8,9,10,11,12,14,15,16-Dodecahydrocyclopenta[A]Phenanthren-17-Ol

Error correction

(8R,9S,10R,13S,14S,17R)-13-Ethyl-17-Ethynyl-3-Hydroxyimino-1,2,6,7,8,9,10,11,12,14,15,16-Dodecahydrocyclopenta[A]Phenanthren-17-Ol / CAS : 53016-31-2

Appearance solid UN -
HS 29372390 DG Class -
Synonyms (17Alpha)-13-Ethyl-17-Hydroxy-18,19-Dinorpregn-4-En-20-Yn-3-One Oxime (E)- And; Unii-R0Tay3X631; Levonorgestrel Oxime; 17-Desacetyl Norgestimate; 18-Methylnorethindrone Oxime; Norplant 3-Oxime; Norelgestromin; 17-Deacetylnorgestimate; D-Norgestrel 3-Oxime; 17-Deacetylated Norgestimate; Norgestimate Metabolite Norelgestromin; Evra; Ortho Evra
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Properties

Summary

Formula
C21H29NO2
Molecular Mass
327.46000
Exact Mass
327.22000
PSA
52.82000
Logp
4.14370
IUPAC
(3E,8R,9S,10R,13S,14S,17R)-13-ethyl-17-ethynyl-3-hydroxyimino-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-ol
SMILES
CC[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@]2(C#C)O)CCC4=C/C(=N/O)/CC[C@H]34

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Raw Materials

Chemical and Physical Properties

Melting Point
107-109ºC
Density
1.23g/cm3
Boiling Point
491.9ºC
Flash Point
327.1ºC
Appearance
solid
Acidity and Basicity
neutral

Export information

HS Code
29372390
Export Rebate
13%

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