Product Code

TRC-E888095

CAS Number

95960-05-7

Product Format

Neat

Molecular Formula

C25 H34 O3

Molecular Weight

382.536

Product Categories

TRC, Pharmaceutical Toxicology Reference Materials

Product Type

Impurity

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Delta9(11)-Estradiol 17-Hexanoate

CAS Number

95960-05-7

Molecular Formula

C25 H34 O3

Molecular Weight

382.536

Accurate Mass

382.251

SMILES

CCCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCc4cc(O)ccc4C3=CC[C@]12C

InChI

InChI=1S/C25H34O3/c1-3-4-5-6-7-24(27)28-23-13-12-22-21-10-8-17-16-18(26)9-11-19(17)20(21)14-15-25(22,23)2/h9,11,14,16,21-23,26H,3-8,10,12-13,15H2,1-2H3/t21-,22+,23+,25+/m1/s1

IUPAC

[(8S,13S,14S,17S)-3-hydroxy-13-methyl-6,7,8,12,14,15,16,17-octahydrocyclopenta[a]phenanthren-17-yl] heptanoate

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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∆9(11)-Estradiol 17-Hexanoate

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