Cas no 78524-74-0 (Hexanoic acid,5-amino-6-hydroxy-4-oxo-)
78524-74-0 structure
Product Name:Hexanoic acid,5-amino-6-hydroxy-4-oxo-
CAS No:78524-74-0
MF:C6H11NO4
MW:161.155842065811
CID:572550
PubChem ID:174149
Update Time:2025-04-19
Hexanoic acid,5-amino-6-hydroxy-4-oxo- Chemical and Physical Properties
Names and Identifiers
-
- Hexanoic acid,5-amino-6-hydroxy-4-oxo-
- 4-keto-5-amino-6-hydroxyhexanoic acid
- 5-amino-6-hydroxy-4-oxohexanoic acid
- DTXSID80999822
- Hexanoic acid, 5-amino-6-hydroxy-4-oxo-
- KA-6-Hha
- 78524-74-0
- SCHEMBL16431298
-
- Inchi： 1S/C6H11NO4/c7-4(3-8)5(9)1-2-6(10)11/h4,8H,1-3,7H2,(H,10,11)
- InChI Key： PLPRTZMQOHOKQU-UHFFFAOYSA-N
- SMILES： OCC(C(CCC(=O)O)=O)N
Computed Properties
- Exact Mass: 161.06880783g/mol
- Monoisotopic Mass: 161.06880783g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 11
- Rotatable Bond Count: 5
- Complexity: 157
- 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: -4.5
- Topological Polar Surface Area: 101?2
Hexanoic acid,5-amino-6-hydroxy-4-oxo- Related Literature
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Hamid Heydari,Mohammad B. Gholivand New J. Chem., 2017,41, 237-244
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Michael Kappl,Paul M. Young,Daniela Traini,Sanyog Jain RSC Adv., 2016,6, 25789-25798
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
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Xue-Ying Wang,Ying Pei,Min Xie,Zi-He Jin,Ya-Shi Xiao,Yang Wang,Li-Na Zhang,Yan Li,Wei-Hua Huang Lab Chip, 2015,15, 1178-1187
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