Cas no 78382-95-3 (2H-1,3-Diazepin-2-one, 1,3-diethylhexahydro-)
78382-95-3 structure
Product Name:2H-1,3-Diazepin-2-one, 1,3-diethylhexahydro-
CAS No:78382-95-3
MF:C9H18N2O
MW:170.252022266388
CID:534586
PubChem ID:12867750
Update Time:2025-04-19
2H-1,3-Diazepin-2-one, 1,3-diethylhexahydro- Chemical and Physical Properties
Names and Identifiers
-
- 2H-1,3-Diazepin-2-one, 1,3-diethylhexahydro-
- 1,3-diethyl-1,3-diazepan-2-one
- DTXSID30511917
- CHEMBL11981
- SCHEMBL10416543
- 78382-95-3
-
- Inchi： 1S/C9H18N2O/c1-3-10-7-5-6-8-11(4-2)9(10)12/h3-8H2,1-2H3
- InChI Key： KDNKVGOBPIWZSY-UHFFFAOYSA-N
- SMILES： O=C1N(CC)CCCCN1CC
Computed Properties
- Exact Mass: 170.141913202g/mol
- Monoisotopic Mass: 170.141913202g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 12
- Rotatable Bond Count: 2
- Complexity: 143
- 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
- XLogP3: 1
- Topological Polar Surface Area: 23.6?2
2H-1,3-Diazepin-2-one, 1,3-diethylhexahydro- Related Literature
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1. An amorphous lanthanum–iridium solid solution with an open structure for efficient water splitting?Wei Sun,Chenglong Ma,Xinlong Tian,Jianjun Liao,Ji Yang,Chengjun Ge,Weiwei Huang J. Mater. Chem. A, 2020,8, 12518-12525
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Karl Crowley,Eimer O'Malley,Aoife Morrin,Malcolm R. Smyth,Anthony J. Killard Analyst, 2008,133, 391-399
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Patricia A. A. M. Vaz,Jo?o Rocha,Artur M. S. Silva New J. Chem., 2016,40, 8198-8201
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
78382-95-3 (2H-1,3-Diazepin-2-one, 1,3-diethylhexahydro-) Related Products
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