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Structure

Estra-1,3,5(10),16-tetraene-3,17-diol diacetate

CAS
20592-42-1
Catalog Number
ACM20592421
Category
Other Products
Molecular Weight
354.439440 [g/mol]
Molecular Formula
C22H26O4

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Specification

Synonyms
Estrone enol diacetate, MolPort-003-893-173, CID89358, NSC97079, EINECS 243-899-7, Estra-1,3,5(10),16-tetraene-3,17-diol, diacetate, Estra-1,3,5(10),16-tetraene-3,17-diol diacetate, 20592-42-1
IUPAC Name
(3-acetyloxy-13-methyl-6,7,8,9,11,12,14,15-octahydrocyclopenta[a]phenanthren-17-yl) acetate
Canonical SMILES
CC(=O)OC1=CCC2C1(CCC3C2CCC4=C3C=CC(=C4)OC(=O)C)C
InChI Key
KPJNGUPMJAHAND-UHFFFAOYSA-N
Boiling Point
490.8ºC at 760 mmHg
Flash Point
245.3ºC
Density
1.19g/cm³
EC Number
243-899-7
Exact Mass
354.18300
H-Bond Acceptor
4
H-Bond Donor
0
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