Cas no 920749-99-1 (2H-Azepin-2-one, 1,5,6,7-tetrahydro-7-propyl-, (7R)-)
920749-99-1 structure
Product Name:2H-Azepin-2-one, 1,5,6,7-tetrahydro-7-propyl-, (7R)-
CAS No:920749-99-1
MF:C9H15NO
MW:153.221502542496
CID:755453
PubChem ID:71423926
Update Time:2025-04-19
2H-Azepin-2-one, 1,5,6,7-tetrahydro-7-propyl-, (7R)- Chemical and Physical Properties
Names and Identifiers
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- 2H-Azepin-2-one, 1,5,6,7-tetrahydro-7-propyl-, (7R)-
- (2R)-2-propyl-1,2,3,4-tetrahydroazepin-7-one
- DTXSID10842731
- (7R)-7-Propyl-1,5,6,7-tetrahydro-2H-azepin-2-one
- 920749-99-1
-
- Inchi： 1S/C9H15NO/c1-2-5-8-6-3-4-7-9(11)10-8/h4,7-8H,2-3,5-6H2,1H3,(H,10,11)/t8-/m1/s1
- InChI Key： GVMZKXQESLKQFB-MRVPVSSYSA-N
- SMILES： O=C1C=CCC[C@@H](CCC)N1
Computed Properties
- Exact Mass: 153.115364102g/mol
- Monoisotopic Mass: 153.115364102g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 2
- Complexity: 163
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.8
- Topological Polar Surface Area: 29.1?2
2H-Azepin-2-one, 1,5,6,7-tetrahydro-7-propyl-, (7R)- Related Literature
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Zhiyan Chen,Nan Wu,Yaobing Wang,Bing Wang,Yingde Wang J. Mater. Chem. A, 2018,6, 516-526
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Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
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Ana G. Neo,Ana Bornadiego,Jesús Díaz,Stefano Marcaccini,Carlos F. Marcos Org. Biomol. Chem., 2013,11, 6546-6555
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