Cas no 62084-30-4 (Pyrido[1,2-a]azepin-9(6H)-one, octahydro-)
62084-30-4 structure
Product Name:Pyrido[1,2-a]azepin-9(6H)-one, octahydro-
CAS No:62084-30-4
MF:C10H17NO
MW:167.248082876205
CID:458769
PubChem ID:12341690
Update Time:2025-04-19
Pyrido[1,2-a]azepin-9(6H)-one, octahydro- Chemical and Physical Properties
Names and Identifiers
-
- Pyrido[1,2-a]azepin-9(6H)-one, octahydro-
- 1-azabicyclo[5.4.0]undecan-5-one
- 2,3,4,6,7,8,10,10a-octahydro-1H-pyrido[1,2-a]azepin-9-one
- 62084-30-4
- DTXSID30492050
- octahydropyrido[1,2-a]azepin-9(6h)-one
- SCHEMBL863645
-
- Inchi: 1S/C10H17NO/c12-10-5-3-7-11-6-2-1-4-9(11)8-10/h9H,1-8H2
- InChI Key: UEDKJTIVKXPUEO-UHFFFAOYSA-N
- SMILES: O=C1CCCN2CCCCC2C1
Computed Properties
- Exact Mass: 167.13111
- Monoisotopic Mass: 167.131014166g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 179
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1
- Topological Polar Surface Area: 20.3?2
Experimental Properties
- PSA: 20.31
Pyrido[1,2-a]azepin-9(6H)-one, octahydro- Related Literature
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Juan J. Sánchez,Miguel López-Haro,Juan C. Hernández-Garrido,Ginesa Blanco,Miguel A. Cauqui,José M. Rodríguez-Izquierdo,José A. Pérez-Omil,José J. Calvino,María P. Yeste J. Mater. Chem. A, 2019,7, 8993-9003
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Xiang Liu,Qian Sun,A. B. Djuri?i?,Maohai Xie,Baohu Dai,Jinyao Tang,Charles Surya,Changzhong Liao,Kaimin Shih RSC Adv., 2015,5, 100783-100789
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3. 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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R. M. Pemberton,J. P. Hart,T. T. Mottram Analyst, 2001,126, 1866-1871
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Bidyut Kumar Kundu,Rinky Singh,Ritudhwaj Tiwari,Debasis Nayak New J. Chem., 2019,43, 4867-4877
62084-30-4 (Pyrido[1,2-a]azepin-9(6H)-one, octahydro-) Related Products
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