1-Dodecyn-4-ol
TL;DR: 1-Dodecyn-4-ol (CAS 74646-36-9) is a chemical compound with molecular formula C12H22O and molecular weight 182.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dodec-1-yn-4-ol
Also Known As: 1-Dodecyn-4-ol, dodec-1-yn-4-ol, 1-(2-Propynyl)nonan-1-ol, RefChem:75656
| Molecular Formula | C12H22O |
|---|---|
| Molecular Weight | 182.17 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 8 |
| Exact Mass | 182.16707 |
| Heavy Atoms | 13 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 74646-36-9 |
|---|---|
| SMILES | CCCCCCCCC(CC#C)O |
| InChIKey | ABQRRMVVOGPNRA-UHFFFAOYSA-N |
Product Overview
1-Dodecyn-4-ol (CAS 74646-36-9), with molecular formula C12H22O and molecular weight 182.17 g/mol. IUPAC: dodec-1-yn-4-ol.
Chemical Property Profile of 1-Dodecyn-4-ol
Property Insights of 1-Dodecyn-4-ol
The XLogP value of 4.1 indicates that 1-Dodecyn-4-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 1-Dodecyn-4-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Dodecyn-4-ol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-Dodecyn-4-ol?
The CAS number of 1-Dodecyn-4-ol is 74646-36-9.
What is the molecular formula of 1-Dodecyn-4-ol?
The molecular formula of 1-Dodecyn-4-ol is C12H22O.
What is the molecular weight of 1-Dodecyn-4-ol?
The molecular weight of 1-Dodecyn-4-ol is 182.17 g/mol.
Where can I buy 1-Dodecyn-4-ol?
You can request a quote for 1-Dodecyn-4-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Dodecyn-4-ol?
Yes, KEHONG BIO provides custom synthesis services for 1-Dodecyn-4-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.