Cas no 20810-18-8 (1-Nonyn-4-ol)
1-Nonyn-4-ol structure
Product Name:1-Nonyn-4-ol
CAS No:20810-18-8
MF:C9H16O
MW:140.222743034363
CID:1396280
PubChem ID:10986322
Update Time:2025-04-20
1-Nonyn-4-ol Chemical and Physical Properties
Names and Identifiers
-
- 1-Nonyn-4-ol
- non-1-yn-4-ol
- SCHEMBL10916842
- AKOS013217137
- 20810-18-8
- DNHMBZFEOTWFKP-UHFFFAOYSA-N
- DTXSID90450737
-
- Inchi： 1S/C9H16O/c1-3-5-6-8-9(10)7-4-2/h2,9-10H,3,5-8H2,1H3
- InChI Key： DNHMBZFEOTWFKP-UHFFFAOYSA-N
- SMILES： OC(CC#C)CCCCC
Computed Properties
- Exact Mass: 140.12018
- Monoisotopic Mass: 140.120115130g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 5
- Complexity: 109
- 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: 2.5
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- PSA: 20.23
1-Nonyn-4-ol Related Literature
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Sheng Wang,Wenxian Xie,Xiu Zhang,Xia Zou,Yan Zhang Chem. Commun., 2012,48, 5907-5909
-
Eric Besson,Stéphane Gastaldi,Emily Bloch,Selma Aslan,Hakim Karoui,Olivier Ouari,Micael Hardy Analyst, 2019,144, 4194-4203
-
Jadwiga Frelek,Marcin Górecki,Marta ?aszcz,Agata Suszczyńska,Elemér Vass,Wojciech J. Szczepek Chem. Commun., 2012,48, 5295-5297
-
Ji-Ping Wei Nanoscale, 2015,7, 11815-11832
-
Erika A. Cobar,Paul R. Horn,Robert G. Bergman,Martin Head-Gordon Phys. Chem. Chem. Phys., 2012,14, 15328-15339
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