Cas no 5648-17-9 (3,7-dibenzyl-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one)
![3,7-dibenzyl-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one structure](https://ossimg.kuujia.com/scimg/6000/5648-17-9x500.png)
5648-17-9 structure
Product Name:3,7-dibenzyl-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one
CAS No:5648-17-9
MF:C23H28N2O
MW:348.481225967407
CID:1598984
PubChem ID:827719
Update Time:2025-04-21
3,7-dibenzyl-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one Chemical and Physical Properties
Names and Identifiers
-
- 3,7-dibenzyl-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one
- 3,7-Diazabicyclo[3.3.1]nonan-9-one, 1,5-dimethyl-3,7-bis(phenylmethyl)-
- 3,7-Dibenzyl-1,5-dimethyl-3,7-diaza-bicyclo[3.3.1]nonan-9-one
- HMS1479L07
- Oprea1_265337
- AB00091652-01
- DTXSID40356639
- SR-01000465407
- STK722597
- ChemDiv3_002361
- CCG-18522
- HMS2674G16
- AKOS000505928
- 5648-17-9
- Oprea1_418394
- CHEMBL1369155
- MLS000856396
- BRD-K86929910-001-01-9
- SR-01000465407-1
- SMR000279341
- SR-01000465407-3
-
- Inchi： 1S/C23H28N2O/c1-22-15-24(13-19-9-5-3-6-10-19)17-23(2,21(22)26)18-25(16-22)14-20-11-7-4-8-12-20/h3-12H,13-18H2,1-2H3
- InChI Key： GKEOZRFZPOMNLN-UHFFFAOYSA-N
- SMILES： O=C1C2(C)CN(CC3C=CC=CC=3)CC1(C)CN(CC1C=CC=CC=1)C2
Computed Properties
- Exact Mass: 348.22034
- Monoisotopic Mass: 348.220164
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 26
- Rotatable Bond Count: 4
- Complexity: 448
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 23.6
- XLogP3: 3.3
Experimental Properties
- Density: 1.141
- Boiling Point: 469.7°C at 760 mmHg
- Flash Point: 186.9°C
- Refractive Index: 1.604
- PSA: 23.55
3,7-dibenzyl-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-9-one Related Literature
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
-
James D. Kirkham,Patrick M. Delaney,George J. Ellames,Eleanor C. Row,Joseph P. A. Harrity Chem. Commun., 2010,46, 5154-5156
-
H. V. Jain,D. Verthelyi,S. L. Beaucage RSC Adv., 2017,7, 42519-42528
-
Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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