Cas no 176249-91-5 (Propanamide,2-(acetylamino)-N-(2-methylpropyl)-)
176249-91-5 structure
Product Name:Propanamide,2-(acetylamino)-N-(2-methylpropyl)-
CAS No:176249-91-5
MF:C9H18N2O2
MW:186.251422405243
CID:112299
PubChem ID:10631418
Update Time:2025-04-18
Propanamide,2-(acetylamino)-N-(2-methylpropyl)- Chemical and Physical Properties
Names and Identifiers
-
- Propanamide,2-(acetylamino)-N-(2-methylpropyl)-
- Propanamide, 2-(acetylamino)-N-(2-methylpropyl)-
- AKOS008932109
- 176249-91-5
- Propanamide, 2-(acetylamino)-N-(2-methylpropyl)-
-
- Inchi： 1S/C9H18N2O2/c1-6(2)5-10-9(13)7(3)11-8(4)12/h6-7H,5H2,1-4H3,(H,10,13)(H,11,12)
- InChI Key： YZRZQWBUSSHJKP-UHFFFAOYSA-N
- SMILES： O=C(C(C)NC(C)=O)NCC(C)C
Computed Properties
- Exact Mass: 186.13694
- Monoisotopic Mass: 186.136827821g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 190
- 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: 0.1
- Topological Polar Surface Area: 58.2?2
Experimental Properties
- PSA: 58.2
Propanamide,2-(acetylamino)-N-(2-methylpropyl)- Related Literature
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Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
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J. M. Granadino-Roldán,M. Fernández-Gómez,A. Navarro,T. Pe?a Ruiz,U. A. Jayasooriya Phys. Chem. Chem. Phys., 2004,6, 1133-1143
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Eunhak Lim,Jiyoung Heo,Seong Keun Kim Nanoscale, 2019,11, 11369-11378
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Robert P. Davies,Maria A. Giménez,Laura Patel,Andrew J. P. White Dalton Trans., 2008, 5705-5707
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