Basic information
- CAS
22034-63-5- Standard SMILES
CCCOc1ccc2c(c1)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](O)CC[C@@H]12- InChIKey
OKWLCMYNQNHQSR-MJCUULBUSA-N- Molecular formula
- C21H30O2
- Average molar mass
- 314.5 g/mol
- Monoisotopic mass
- 314.2245802
Names & identifiers
- Preferred name
- Estradiol 3-propyl ether
- IUPAC
- (8R,9S,13S,14S,17S)-13-methyl-3-propoxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol
- English name
- estradiol 3-propyl ether
- Molecular weight
- 0
Names & synonyms
Estradiol 3-propyl ether22034-63-5RefChem:1379133-propoxyestra-1,3,5(10)-trien-17 beta-ol(8R,9S,13S,14S,17S)-13-methyl-3-propoxy-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol(17ss)-3-Propoxyestra-1,3,5(10)-trien-17-ol, Estra-1,3,5(10)-trien-17ss-ol, 3-propoxy- (8CI); (17ss)-3-Propoxyestra-1,3,5(10)-trien-17-ol; Estradiol 3-propyl etherSCHEMBL28503910DTXSID609446383-Propoxyestra-1(10),2,4-trien-17-ol3-Propoxyestra-1(10),2,4-trien-17beta-ol3-Propoxyestra-1,3,5(10)-trien-17beta-ol(8R,9S,13S,14S,17S)-13-methyl-3-propoxy-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-17-ol
Show more names
Promestriene Impurity 1
Database identifiers
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 422
Physicochemical properties
- Melting point
- 100 · 100-102°C
- storage temp.
- Refrigerator
- solubility
- DMSO (Slightly), Ethanol (Slightly), Ethyl Acetate (Slightly)
- form
- Solid
- color
- White to Off-White
Chemistry & industry
Applications
UsesEstradiol 3-Propyl Ether is a derivative of 17β-Estradiol (E888000) which functions as the major estrogen secreted by the premenopausal ovary.
Suppliers8 total
湖北瑞玛标物科技有限公司15787879035 15787875101 · [email protected]
廊坊市恒福源医药科技有限公司0316-2883537 19333636468 · [email protected]
廊坊市泽康医药科技有限公司0316-2883536 19333636468 · [email protected]
TLC梯尔希（南京）药物研发有限公司18012923235 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
艾吉析科技（上海）有限公司17717235263 17717235263 · [email protected]
深圳博泰尔生物技术有限公司13316949107 13316968096 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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