Cas no 57753-55-6 (Octanamide, 4-hydroxy-N-methyl-)
57753-55-6 structure
Product Name:Octanamide, 4-hydroxy-N-methyl-
CAS No:57753-55-6
MF:C9H19NO2
MW:173.25266289711
CID:344306
PubChem ID:11073889
Update Time:2025-04-19
Octanamide, 4-hydroxy-N-methyl- Chemical and Physical Properties
Names and Identifiers
-
- Octanamide, 4-hydroxy-N-methyl-
- 4-hydroxy-N-methyloctanamide
- 57753-55-6
- DTXSID60454202
-
- Inchi： 1S/C9H19NO2/c1-3-4-5-8(11)6-7-9(12)10-2/h8,11H,3-7H2,1-2H3,(H,10,12)
- InChI Key： SRQJIUKIRKAMDK-UHFFFAOYSA-N
- SMILES： OC(CCC(NC)=O)CCCC
Computed Properties
- Exact Mass: 173.14167
- Monoisotopic Mass: 173.141578849g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 12
- Rotatable Bond Count: 6
- Complexity: 126
- 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: 1
- Topological Polar Surface Area: 49.3?2
Experimental Properties
- PSA: 49.33
Octanamide, 4-hydroxy-N-methyl- Related Literature
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S. Amaresh,K. Karthikeyan,K. J. Kim,Y. S. Lee RSC Adv., 2014,4, 23107-23115
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Stephen P. Fletcher,Richard B. C. Jagt,Ben L. Feringa Chem. Commun., 2007, 2578-2580
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
-
Kaiyuan Huang,Wangkang Qiu,Meilian Ou,Xiaorui Liu,Zenan Liao,Sheng Chu RSC Adv., 2020,10, 18824-18829
-
Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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