Cas no 23580-51-0 (1-Octyn-3-ol, 3-methyl-)
1-Octyn-3-ol, 3-methyl- structure
Product Name:1-Octyn-3-ol, 3-methyl-
1-Octyn-3-ol, 3-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1-Octyn-3-ol, 3-methyl-
- 3-METHYL-1-OCTYN-3-OL
- 3-methyloct-1-yn-3-ol
- 1-Octyn-3-ol,3-methyl
- 3-hydroxy-3-methyl-1-octyne
- 3-Methyl-oct-1-in-3-ol
- 3-methyl-oct-1-yn-3-ol
- EINECS 245-751-7
- methyl-n-amyl ethynyl carbinol
- Methyl-n-amyl-acetylenyl-carbinol
- Methyl-pentyl-aethinyl-carbinol
- DTXSID30865104
- 23580-51-0
- AKOS006227596
- ZBDMJPAJZFSKPR-UHFFFAOYSA-N
- FT-0616037
- Q67879592
- (+/-)-3-Methyl-1-octyn-3-ol
- NS00051891
- MFCD00041581
- SCHEMBL1056747
-
- Inchi： 1S/C9H16O/c1-4-6-7-8-9(3,10)5-2/h2,10H,4,6-8H2,1,3H3
- InChI Key： ZBDMJPAJZFSKPR-UHFFFAOYSA-N
- SMILES： OC(C#C)(C)CCCCC
Computed Properties
- Exact Mass: 140.12000
- Monoisotopic Mass: 140.12
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 10
- Rotatable Bond Count: 5
- Complexity: 131
- 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
- Topological Polar Surface Area: 20.2A^2
- XLogP3: 2.2
Experimental Properties
- Density: 0,855 g/cm3
- Melting Point: -16°C (estimate)
- Boiling Point: 174-176°C
- Flash Point: 57°C
- Refractive Index: 1.4400
- PSA: 20.23000
- LogP: 1.95090
1-Octyn-3-ol, 3-methyl- Customs Data
- HS CODE：2905290000
- Customs Data：
China Customs Code:
2905290000Overview:
2905290000 Other unsaturated monohydric alcohols.Regulatory conditions:nothing.VAT:17.0%.Tax refund rate:9.0%.MFN tariff:5.5%.general tariff:30.0%
Declaration elements:
Product Name, component content, use to, packing
Summary:
2905290000 unsaturated monohydric alcohols.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:5.5%.General tariff:30.0%
1-Octyn-3-ol, 3-methyl- Related Literature
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
-
2. An autonomous self-optimizing flow machine for the synthesis of pyridine–oxazoline (PyOX) ligands?Eric Wimmer,Daniel Cortés-Borda,Solène Brochard,Elvina Barré,Charlotte Truchet,Fran?ois-Xavier Felpin React. Chem. Eng., 2019,4, 1608-1615
-
Luis Miguel Azofra,Douglas R. MacFarlane,Chenghua Sun Chem. Commun., 2016,52, 3548-3551
-
Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
-
Huifang Yang,Haoran Guo,Peidong Fan,Xinpan Li,Wenlu Ren,Rui Song Nanoscale, 2020,12, 7024-7034
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