Cas no 61716-10-7 (5-Nonanone, 1-hydroxy-)
5-Nonanone, 1-hydroxy- structure
Product Name:5-Nonanone, 1-hydroxy-
CAS No:61716-10-7
MF:C9H18O2
MW:158.238023281097
CID:468719
PubChem ID:14587903
Update Time:2025-04-19
5-Nonanone, 1-hydroxy- Chemical and Physical Properties
Names and Identifiers
-
- 5-Nonanone, 1-hydroxy-
- 1-hydroxynonan-5-one
- 1-Hydroxy-5-nonanone
- SCHEMBL2529841
- DTXSID10561930
- 61716-10-7
-
- Inchi： 1S/C9H18O2/c1-2-3-6-9(11)7-4-5-8-10/h10H,2-8H2,1H3
- InChI Key： ZFBDCQRXEHJKHT-UHFFFAOYSA-N
- SMILES： O=C(CCCC)CCCCO
Computed Properties
- Exact Mass: 158.13074
- Monoisotopic Mass: 158.130679813g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 7
- Complexity: 99.7
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.3
- Topological Polar Surface Area: 37.3?2
Experimental Properties
- PSA: 37.3
5-Nonanone, 1-hydroxy- Related Literature
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Huading Zhang,Lee R. Moore,Maciej Zborowski,P. Stephen Williams,Shlomo Margel,Jeffrey J. Chalmers Analyst, 2005,130, 514-527
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Chao-Han Cheng,Wen-Zhen Wang,Shie-Ming Peng,I-Chia Chen Phys. Chem. Chem. Phys., 2017,19, 25471-25477
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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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
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Jason Y. C. Lim,Yong Yu,Guorui Jin,Kai Li,Yi Lu,Jianping Xie Nanoscale Adv., 2020,2, 3921-3932
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