Cas no 61267-83-2 (3,7-Diazabicyclo[3.3.1]nonan-2-one, 3,7-dimethyl-)
![3,7-Diazabicyclo[3.3.1]nonan-2-one, 3,7-dimethyl- structure](https://ossimg.kuujia.com/scimg/61500/61267-83-2x500.png)
61267-83-2 structure
Product Name:3,7-Diazabicyclo[3.3.1]nonan-2-one, 3,7-dimethyl-
CAS No:61267-83-2
MF:C9H16N2O
MW:168.236142158508
CID:486489
PubChem ID:12360829
Update Time:2025-04-19
3,7-Diazabicyclo[3.3.1]nonan-2-one, 3,7-dimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 3,7-Diazabicyclo[3.3.1]nonan-2-one, 3,7-dimethyl-
- 3,7-dimethyl-3,7-diazabicyclo[3.3.1]nonan-4-one
- 3,7-Dimethyl-3,7-diazabicyclo[3.3.1]nonan-2-one
- 61267-83-2
- DTXSID00494026
-
- Inchi： 1S/C9H16N2O/c1-10-4-7-3-8(6-10)9(12)11(2)5-7/h7-8H,3-6H2,1-2H3
- InChI Key： DELSPSPNQFOREZ-UHFFFAOYSA-N
- SMILES： O=C1C2CN(C)CC(CN1C)C2
Computed Properties
- Exact Mass: 168.12638
- Monoisotopic Mass: 168.126263138g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- 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
- XLogP3: -0.1
- Topological Polar Surface Area: 23.6?2
Experimental Properties
- PSA: 23.55
3,7-Diazabicyclo[3.3.1]nonan-2-one, 3,7-dimethyl- Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
-
Nan Fu,Naphaporn Chiewchan,Xiao Dong Chen Food Funct., 2020,11, 211-220
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5. Fatty acid eutectic mixtures and derivatives from non-edible animal fat as phase change materials?Pau Gallart-Sirvent,Marc Martín,Gemma Villorbina,Mercè Balcells,Aran Solé,Luisa F. Cabeza,Ramon Canela-Garayoa RSC Adv., 2017,7, 24133-24139
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