Cas no 5659-19-8 (2-ethyl-3-oxo-n-phenylhexanamide)
5659-19-8 structure
Product Name:2-ethyl-3-oxo-n-phenylhexanamide
CAS No:5659-19-8
MF:C14H19NO2
MW:233.30616402626
CID:945584
PubChem ID:268280
Update Time:2025-04-19
2-ethyl-3-oxo-n-phenylhexanamide Chemical and Physical Properties
Names and Identifiers
-
- 2-ethyl-3-oxo-n-phenylhexanamide
- 2-Aethyl-3-oxo-hexansaeure-anilid
- 2-ethyl-3-oxo-hexanoic acid anilide
- 3-Oxo-2-aethyl-hexansaeure-phenylamid
- AC1L6JXM
- AC1Q5N76
- AR-1E1452
- NSC108437
- DS-013228
- 5659-19-8
- 2-ethyl-3-oxo-N-phenyl-hexanamide
- DTXSID50296239
- NSC-108437
-
- Inchi： 1S/C14H19NO2/c1-3-8-13(16)12(4-2)14(17)15-11-9-6-5-7-10-11/h5-7,9-10,12H,3-4,8H2,1-2H3,(H,15,17)
- InChI Key： XVVQBWPYLLZVOD-UHFFFAOYSA-N
- SMILES： O=C(CCC)C(C(NC1C=CC=CC=1)=O)CC
Computed Properties
- Exact Mass: 233.14167
- Monoisotopic Mass: 233.142
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 17
- Rotatable Bond Count: 6
- Complexity: 257
- 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: 3.3
- Topological Polar Surface Area: 46.2?2
Experimental Properties
- Density: 1.065
- Boiling Point: 407°C at 760 mmHg
- Flash Point: 155.3°C
- Refractive Index: 1.536
- PSA: 46.17
- LogP: 3.09350
2-ethyl-3-oxo-n-phenylhexanamide Related Literature
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Vishwesh Venkatraman,Marco Foscato,Vidar R. Jensen,Bj?rn K?re Alsberg J. Mater. Chem. A, 2015,3, 9851-9860
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Christopher J. Harrison,Kyle J. Berean,Enrico Della Gaspera,Jian Zhen Ou,Richard B. Kaner,Kourosh Kalantar-zadeh,Torben Daeneke Nanoscale, 2016,8, 16276-16283
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