Cas no 93754-82-6 ((7R,11S)-7-methyl-2,3,7,8,9,11-hexahydro-4,11-propanocyclopenta[e]azecine-5,10(1H,6H)-dione)
![(7R,11S)-7-methyl-2,3,7,8,9,11-hexahydro-4,11-propanocyclopenta[e]azecine-5,10(1H,6H)-dione structure](https://ossimg.kuujia.com/scimg/94000/93754-82-6x500.png)
93754-82-6 structure
Product Name:(7R,11S)-7-methyl-2,3,7,8,9,11-hexahydro-4,11-propanocyclopenta[e]azecine-5,10(1H,6H)-dione
CAS No:93754-82-6
MF:C16H23NO2
MW:261.35932469368
CID:1981560
PubChem ID:179733
Update Time:2025-04-21
(7R,11S)-7-methyl-2,3,7,8,9,11-hexahydro-4,11-propanocyclopenta[e]azecine-5,10(1H,6H)-dione Chemical and Physical Properties
Names and Identifiers
-
- (7R,11S)-7-methyl-2,3,7,8,9,11-hexahydro-4,11-propanocyclopenta[e]azecine-5,10(1H,6H)-dione
- 7-Methyl-2,3,7,8,9,11-hexahydro-4,11-propanocyclopenta[e]azecine-5,10(1H,6H)-dione
- 93754-82-6
- Phlegmariurine A
- 4,11-Propano-4H-cyclopent(e)azecine-5,10(1H, 6H)-dione, 2,3,7,8,9,11-hexahydro-7-methyl-, (7R,11S)-
- DTXSID10918162
- (1S,6R)-6-methyl-9-azatricyclo[7.4.3.04,13]hexadec-4(13)-ene-2,8-dione
- (1S,6R)-6-methyl-9-azatricyclo(7.4.3.04,13)hexadec-4(13)-ene-2,8-dione
-
- Inchi： 1S/C16H23NO2/c1-11-8-12-10-15(18)14-5-3-7-17(16(19)9-11)6-2-4-13(12)14/h11,14H,2-10H2,1H3/t11-,14+/m1/s1
- InChI Key： OFVBIHDTBLOLMM-RISCZKNCSA-N
- SMILES： O=C1CC2C[C@@H](C)CC(N3CCCC=2[C@@H]1CCC3)=O
Computed Properties
- Exact Mass: 261.173
- Monoisotopic Mass: 261.173
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 0
- Complexity: 438
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 2
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1
- Topological Polar Surface Area: 37.4?2
Experimental Properties
- Density: 1.13
- Boiling Point: 443.6°C at 760 mmHg
- Flash Point: 199.6°C
- Refractive Index: 1.55
(7R,11S)-7-methyl-2,3,7,8,9,11-hexahydro-4,11-propanocyclopenta[e]azecine-5,10(1H,6H)-dione Related Literature
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Yong Ping Huang,Tao Tao,Zheng Chen,Wei Han,Ying Wu,Chunjiang Kuang,Shaoxiong Zhou,Ying Chen J. Mater. Chem. A, 2014,2, 18831-18837
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Long Deng,Qian Zou,Biao Liu,Wenhui Ye,Chengfei Zhuo,Li Chen,Ze-Yuan Deng,Ya-Wei Fan,Jing Li Food Funct., 2018,9, 4234-4245
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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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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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