Cas no 252847-27-1 (Estr-4-en-3-one, 7-methyl-17-[(1-oxoundecyl)oxy]-, (7a,17b)-)
![Estr-4-en-3-one, 7-methyl-17-[(1-oxoundecyl)oxy]-, (7a,17b)- structure](https://ossimg.kuujia.com/scimg/253000/252847-27-1x500.png)
252847-27-1 structure
Product Name:Estr-4-en-3-one, 7-methyl-17-[(1-oxoundecyl)oxy]-, (7a,17b)-
CAS No:252847-27-1
MF:C30H48O3
MW:456.700329780579
CID:3921403
Update Time:2025-04-03
Estr-4-en-3-one, 7-methyl-17-[(1-oxoundecyl)oxy]-, (7a,17b)- Chemical and Physical Properties
Names and Identifiers
-
- Estr-4-en-3-one, 7-methyl-17-[(1-oxoundecyl)oxy]-, (7a,17b)-
- Estr-4-en-3-one, 7-methyl-17-[(1-oxoundecyl)oxy]-, (7α,17β)-
-
- Inchi： 1S/C30H48O3/c1-4-5-6-7-8-9-10-11-12-28(32)33-27-16-15-26-29-21(2)19-22-20-23(31)13-14-24(22)25(29)17-18-30(26,27)3/h20-21,24-27,29H,4-19H2,1-3H3/t21-,24+,25-,26+,27+,29-,30+/m1/s1
- InChI Key： WRLOOHHQBLTCLM-QKLCDPPYSA-N
- SMILES： C1(=O)C=C2[C@]([H])(CC1)[C@]1([H])[C@]([H])([C@@]3([H])[C@@](CC1)(C)[C@@H](OC(=O)CCCCCCCCCC)CC3)[C@H](C)C2
Experimental Properties
- Density: 1.03±0.1 g/cm3(Predicted)
- Boiling Point: 555.1±50.0 °C(Predicted)
Estr-4-en-3-one, 7-methyl-17-[(1-oxoundecyl)oxy]-, (7a,17b)- Related Literature
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Max Attwood,Hiroki Akutsu,Lee Martin,Toby J. Blundell,Pierre Le Maguere,Scott S. Turner Dalton Trans., 2021,50, 11843-11851
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Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Domenico Lombardo,Gianmarco Munaò,Pietro Calandra,Luigi Pasqua,Maria Teresa Caccamo Phys. Chem. Chem. Phys., 2019,21, 11983-11991
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Martin R. Ward,Gary W. Copeland,Andrew J. Alexander Chem. Commun., 2010,46, 7634-7636
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