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Merck
CN

K2126

β-Estradiol-6-one 6-(O-carboxymethyloxime)

≥98.00% (TLC), powder

Synonym(s):

β-Estradiol-6-(O-carboxymethyl)oxime, 1,3,5(10)-Estratriene-3,17β-diol-6-one6-(O-carboxymethyloxime), 3,17β-Dihydroxy-1,3,5(10)-estratriene 6-(O-carboxymethyl)oxime, 6-Ketoestradiol 6-(O-carboxymethyloxime)

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About This Item

Empirical Formula (Hill Notation):
C20H25NO5
CAS Number:
Molecular Weight:
359.42
NACRES:
NA.77
PubChem Substance ID:
UNSPSC Code:
51111800
MDL number:
Beilstein/REAXYS Number:
2484202
Assay:
≥98.00% (TLC)
Form:
powder
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Product Name

β-Estradiol-6-one 6-(O-carboxymethyloxime),

biological source

synthetic (organic)

Quality Segment

assay

≥98.00% (TLC)

form

powder

solubility

ethanol: 19.60-20.40 mg/mL, clear, colorless to faintly yellow

shipped in

ambient

storage temp.

2-8°C

SMILES string

C[C@]12CC[C@H]3[C@@H](C\C(=N\OCC(O)=O)c4cc(O)ccc34)[C@@H]1CC[C@@H]2O

InChI

1S/C20H25NO5/c1-20-7-6-13-12-3-2-11(22)8-15(12)17(21-26-10-19(24)25)9-14(13)16(20)4-5-18(20)23/h2-3,8,13-14,16,18,22-23H,4-7,9-10H2,1H3,(H,24,25)/b21-17-/t13-,14-,16+,18+,20+/m1/s1

InChI key

AWARIMYXKAIIGO-UYGYUSPXSA-N

General description

β-Estradiol-6-one 6-(O-carboxymethyloxime) is a derivative of 17β-estradiol.


Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)



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