Cas no 10307-00-3 (4-Octyn-3-ol)
4-Octyn-3-ol structure
Product Name:4-Octyn-3-ol
CAS No:10307-00-3
MF:C8H14O
MW:126.196162700653
CID:1135669
PubChem ID:12354326
Update Time:2025-04-20
4-Octyn-3-ol Chemical and Physical Properties
Names and Identifiers
-
- 4-Octyn-3-ol
- oct-4-yn-3-ol
- SCHEMBL4530368
- DTXSID10493606
- 10307-00-3
-
- Inchi： 1S/C8H14O/c1-3-5-6-7-8(9)4-2/h8-9H,3-5H2,1-2H3
- InChI Key： IYTPLTLHQFCOJN-UHFFFAOYSA-N
- SMILES： OC(C#CCCC)CC
Computed Properties
- Exact Mass: 126.104465g/mol
- Monoisotopic Mass: 126.104465g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 2
- Complexity: 115
- 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
- Molecular Weight: 126.2g/mol
- XLogP3: 2.1
- Topological Polar Surface Area: 20.2?2
4-Octyn-3-ol Related Literature
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Jingquan Liu,Huiyun Liu,Zhongfan Jia,Volga Bulmus,Thomas P. Davis Chem. Commun., 2008, 6582-6584
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Soumaya Khlifi,Gregory Mouille,Jonathan Farjon Anal. Methods, 2017,9, 2328-2333
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P. K. Wawrzyniak,M. T. P. Beerepoot,H. J. M. de Groot,F. Buda Phys. Chem. Chem. Phys., 2011,13, 10270-10279
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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