Cas no 653600-88-5 (3,9-Diazabicyclo[4.2.1]nonane, 9-(1-oxopropyl)- (9CI))
![3,9-Diazabicyclo[4.2.1]nonane, 9-(1-oxopropyl)- (9CI) structure](https://ossimg.kuujia.com/scimg/654000/653600-88-5x500.png)
653600-88-5 structure
Product Name:3,9-Diazabicyclo[4.2.1]nonane, 9-(1-oxopropyl)- (9CI)
CAS No:653600-88-5
MF:C10H18N2O
MW:182.262722492218
CID:1020170
PubChem ID:45119410
Update Time:2025-04-20
3,9-Diazabicyclo[4.2.1]nonane, 9-(1-oxopropyl)- (9CI) Chemical and Physical Properties
Names and Identifiers
-
- 3,9-Diazabicyclo[4.2.1]nonane, 9-(1-oxopropyl)- (9CI)
- SCHEMBL2938559
- 3,9-Diazabicyclo[4.2.1]nonane, 9-(1-oxopropyl)-
- DB-271476
- 653600-88-5
-
- Inchi： 1S/C10H18N2O/c1-2-10(13)12-8-3-4-9(12)7-11-6-5-8/h8-9,11H,2-7H2,1H3
- InChI Key： WMDWOVROPQPTLH-UHFFFAOYSA-N
- SMILES： O=C(CC)N1C2CNCCC1CC2
Computed Properties
- Exact Mass: 182.142
- Monoisotopic Mass: 182.142
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 1
- Complexity: 205
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 32.3A^2
- XLogP3: 0.5
3,9-Diazabicyclo[4.2.1]nonane, 9-(1-oxopropyl)- (9CI) Related Literature
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Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Jason Wan Lab Chip, 2020,20, 4528-4538
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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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