Cas no 55182-73-5 (3-Dodecyn-1-ol)
3-Dodecyn-1-ol structure
Product Name:3-Dodecyn-1-ol
CAS No:55182-73-5
MF:C12H22O
MW:182.302484035492
CID:352637
PubChem ID:4108965
Update Time:2025-04-19
3-Dodecyn-1-ol Chemical and Physical Properties
Names and Identifiers
-
- 3-Dodecyn-1-ol
- dodec-3-yn-1-ol
- 55182-73-5
- CMSTUGQLHQXICL-UHFFFAOYSA-N
- DTXSID20399408
- SCHEMBL2483643
-
- Inchi： 1S/C12H22O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h13H,2-8,11-12H2,1H3
- InChI Key： CMSTUGQLHQXICL-UHFFFAOYSA-N
- SMILES： OCCC#CCCCCCCCC
Computed Properties
- Exact Mass: 182.16716
- Monoisotopic Mass: 182.167065321g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 13
- Rotatable Bond Count: 7
- Complexity: 149
- 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: 4.3
- Topological Polar Surface Area: 20.2?2
Experimental Properties
- PSA: 20.23
3-Dodecyn-1-ol Related Literature
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
-
Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
-
David White,Sean R. Stowell Biomater. Sci., 2017,5, 463-474
55182-73-5 (3-Dodecyn-1-ol) Related Products
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