Cas no 96059-70-0 ((17beta)-17-hydroxy-17-propylestr-5(10)-en-3-one)
96059-70-0 structure
Product Name:(17beta)-17-hydroxy-17-propylestr-5(10)-en-3-one
CAS No:96059-70-0
MF:C21H32O2
MW:316.477586746216
CID:1986567
PubChem ID:15888229
Update Time:2025-04-21
(17beta)-17-hydroxy-17-propylestr-5(10)-en-3-one Chemical and Physical Properties
Names and Identifiers
-
- (17beta)-17-hydroxy-17-propylestr-5(10)-en-3-one
- BRN 2593401
- 17-beta-Hydroxy-17-propylestr-5(10)-en-3-one
- 17-alpha-Propyl-19-nor-delta(sup 5(10))-androsten-17-beta-ol-3-one
- 96059-70-0
- SCHEMBL7753698
- ESTR-5(10)-EN-3-ONE, 17-beta-HYDROXY-17-PROPYL-
-
- Inchi： 1S/C21H32O2/c1-3-10-21(23)12-9-19-18-6-4-14-13-15(22)5-7-16(14)17(18)8-11-20(19,21)2/h17-19,23H,3-13H2,1-2H3/t17-,18-,19+,20+,21+/m1/s1
- InChI Key： ABKUMZFLWRHWMV-MJCUULBUSA-N
- SMILES： O[C@@]1(CCC)CC[C@H]2[C@@H]3CCC4CC(CCC=4[C@H]3CC[C@@]21C)=O
Computed Properties
- Exact Mass: 316.240230259Da
- Monoisotopic Mass: 316.240230259Da
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 23
- Rotatable Bond Count: 2
- Complexity: 548
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 5
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3.3
- Topological Polar Surface Area: 37.3?2
(17beta)-17-hydroxy-17-propylestr-5(10)-en-3-one Related Literature
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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