Cas no 102450-10-2 (Hexanamide,2-ethyl-5-methyl-)
Hexanamide,2-ethyl-5-methyl- structure
Product Name:Hexanamide,2-ethyl-5-methyl-
CAS No:102450-10-2
MF:C9H19NO
MW:157.253262758255
CID:181585
PubChem ID:59353
Update Time:2025-04-19
Hexanamide,2-ethyl-5-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Hexanamide,2-ethyl-5-methyl-
- 2-ethyl-5-methylhexanamide
- 102450-10-2
- HEXANAMIDE, 2-ETHYL-5-METHYL-
- 2-Ethyl-5-methylhexanimidic acid
- 3-02-00-00830 (Beilstein Handbook Reference)
- BRN 1754245
- DTXSID70907577
-
- Inchi： 1S/C9H19NO/c1-4-8(9(10)11)6-5-7(2)3/h7-8H,4-6H2,1-3H3,(H2,10,11)
- InChI Key： MXZJHUFPDPEROD-UHFFFAOYSA-N
- SMILES： O=C(C(CC)CCC(C)C)N
Computed Properties
- Exact Mass: 157.14677
- Monoisotopic Mass: 157.147
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 11
- Rotatable Bond Count: 5
- Complexity: 121
- 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
- Topological Polar Surface Area: 43.1A^2
- XLogP3: 2.2
Experimental Properties
- Density: 0.88
- Boiling Point: 289.6°Cat760mmHg
- Flash Point: 129°C
- Refractive Index: 1.441
- PSA: 43.09
- LogP: 3.08380
Hexanamide,2-ethyl-5-methyl- Related Literature
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
-
Joseph W. Bennett,Diamond T. Jones,Blake G. Hudson,Joshua Melendez-Rivera,Robert J. Hamers,Sara E. Mason Environ. Sci.: Nano, 2020,7, 1642-1651
-
Kay S. McMillan,Anthony G. McCluskey,Annette Sorensen,Marie Boyd,Michele Zagnoni Analyst, 2016,141, 100-110
-
Chen Long,Ying Dai,Jianwei Li,Hao Jin Nanoscale, 2020,12, 21124-21130
-
Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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