Cas no 72188-81-9 (15-Oxatricyclo[9.3.2.14,8]heptadec-11-en-16-one,2-hydroxy-1,7,8-trimethyl-17-methylene-, (1R,2S,4R,7S,8R)-)
72188-81-9 structure
Product Name:15-Oxatricyclo[9.3.2.14,8]heptadec-11-en-16-one,2-hydroxy-1,7,8-trimethyl-17-methylene-, (1R,2S,4R,7S,8R)-
CAS No:72188-81-9
MF:C20H30O3
MW:318.450406551361
CID:577410
PubChem ID:433424
Update Time:2025-04-19
15-Oxatricyclo[9.3.2.14,8]heptadec-11-en-16-one,2-hydroxy-1,7,8-trimethyl-17-methylene-, (1R,2S,4R,7S,8R)- Chemical and Physical Properties
Names and Identifiers
-
- 15-Oxatricyclo[9.3.2.14,8]heptadec-11-en-16-one,2-hydroxy-1,7,8-trimethyl-17-methylene-, (1R,2S,4R,7S,8R)-
- (1R,2S,4R,7S,8R)-2-Hydroxy-1,7,8-trimethyl-17-methylene-15-oxatricyclo[9.3.2.14,8]heptadec-11-en-16-one
- CLEOMEOLIDE
- 15-Oxatricyclo[9.3.2.1(4,8)]heptadec-11-en-16-one, 2-hydroxy-1,7,8-trimethyl-17-methylene-, [1R-(1R*,2S*,4R*,7S*,8R*)]-
- AC1L8VE4
- NSC329506
- NSC-329506
- DTXSID50330900
- 72188-81-9
- SHAHCGJNHYXFLV-UHFFFAOYSA-N
-
- Inchi: 1S/C20H30O3/c1-13-7-8-16-12-17(21)20(4)10-5-6-15(18(22)23-20)9-11-19(13,3)14(16)2/h6,13,16-17,21H,2,5,7-12H2,1,3-4H3
- InChI Key: SHAHCGJNHYXFLV-UHFFFAOYSA-N
- SMILES: O1C(C2=CCCC1(C)C(CC1CCC(C)C(C)(CC2)C1=C)O)=O
Computed Properties
- Exact Mass: 318.2196
- Monoisotopic Mass: 318.21949481g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 23
- Rotatable Bond Count: 0
- Complexity: 549
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 5
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 4.4
- Topological Polar Surface Area: 46.5?2
Experimental Properties
- Density: 1.08
- Boiling Point: 474.1°Cat760mmHg
- Flash Point: 190.5°C
- Refractive Index: 1.534
- PSA: 46.53
- LogP: 4.16190
15-Oxatricyclo[9.3.2.14,8]heptadec-11-en-16-one,2-hydroxy-1,7,8-trimethyl-17-methylene-, (1R,2S,4R,7S,8R)- Related Literature
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Tengfei Yu,Yuehan Wu,Wei Li,Bin Li RSC Adv., 2014,4, 34134-34143
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Christopher B. Rodell,Christopher B. Highley,Minna H. Chen,Neville N. Dusaj,Chao Wang,Lin Han,Jason A. Burdick Soft Matter, 2016,12, 7839-7847
-
Peiyuan Zeng,Xiaoxiao Wang,Ming Ye,Qiuyang Ma,Jianwen Li,Wanwan Wang,Baoyou Geng,Zhen Fang RSC Adv., 2016,6, 23074-23084
-
Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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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
72188-81-9 (15-Oxatricyclo[9.3.2.14,8]heptadec-11-en-16-one,2-hydroxy-1,7,8-trimethyl-17-methylene-, (1R,2S,4R,7S,8R)-) Related Products
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