Cas no 7418-15-7 (2H-Azepin-2-one, 5,5'-(1-methylethylidene)bis[hexahydro-)
7418-15-7 structure
Product Name:2H-Azepin-2-one, 5,5'-(1-methylethylidene)bis[hexahydro-
CAS No:7418-15-7
MF:C15H26N2O2
MW:266.379144191742
CID:530834
PubChem ID:71402036
Update Time:2025-04-19
2H-Azepin-2-one, 5,5'-(1-methylethylidene)bis[hexahydro- Chemical and Physical Properties
Names and Identifiers
-
- 5-[2-(7-oxoazepan-4-yl)propan-2-yl]azepan-2-one
- 5,5'-(Propane-2,2-diyl)di(azepan-2-one)
- 7418-15-7
- DTXSID40823038
- 5,5'-Isopropyliden-bis(1-aza-2-cycloheptanon)
- 2H-Azepin-2-one, 5,5'-(1-methylethylidene)bis[hexahydro-
-
- Inchi： 1S/C15H26N2O2/c1-15(2,11-3-5-13(18)16-9-7-11)12-4-6-14(19)17-10-8-12/h11-12H,3-10H2,1-2H3,(H,16,18)(H,17,19)
- InChI Key： PVGQYBADMQJXKJ-UHFFFAOYSA-N
- SMILES： O=C1CCC(CCN1)C(C)(C)C1CCC(NCC1)=O
Computed Properties
- Exact Mass: 266.199428076g/mol
- Monoisotopic Mass: 266.199428076g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 19
- Rotatable Bond Count: 2
- Complexity: 320
- 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: 1.4
- Topological Polar Surface Area: 58.2?2
2H-Azepin-2-one, 5,5'-(1-methylethylidene)bis[hexahydro- Related Literature
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Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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Bo Wei,Zhenyu Liu,Chen Xie,Shu Yang,Wentao Tang,Aiwei Gu,Wing-Tak Wong,Ka-Leung Wong J. Mater. Chem. C, 2015,3, 12322-12327
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Shaun D. Wong,Edward I. Solomon Dalton Trans., 2014,43, 17567-17577
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Sowmyalakshmi Venkataraman RSC Adv., 2015,5, 73807-73813
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