1,2,2a,3,4,5-Hexahydroacenaphthylen-1-ol
TL;DR: 1,2,2a,3,4,5-Hexahydroacenaphthylen-1-ol (CAS 16979-06-9) is a chemical compound with molecular formula C12H14O and molecular weight 174.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,3a,4,5-hexahydroacenaphthylen-1-ol
Also Known As: NCIOpen2_001635, 1,2,2a,3,4,5-hexahydroacenaphthylen-1-ol, 2,3,4,5-tetrahydroacenaphthylen-1-ol, 1,2,3,3a,4,5-hexahydroacenaphthylen-1-ol, 1-Acenaphthylenol, 1,2,2a,3,4,5-hexahydro-
| Molecular Formula | C12H14O |
|---|---|
| Molecular Weight | 174.10 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 174.10446 |
| Heavy Atoms | 13 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 16979-06-9 |
|---|---|
| SMILES | C1CC2CC(C3=CC=CC(=C23)C1)O |
| InChIKey | YTTQJGXLFBPAKM-UHFFFAOYSA-N |
Product Overview
1,2,2a,3,4,5-Hexahydroacenaphthylen-1-ol (CAS 16979-06-9), with molecular formula C12H14O and molecular weight 174.10 g/mol. IUPAC: 1,2,3,3a,4,5-hexahydroacenaphthylen-1-ol.
Chemical Property Profile of 1,2,2a,3,4,5-Hexahydroacenaphthylen-1-ol
Property Insights of 1,2,2a,3,4,5-Hexahydroacenaphthylen-1-ol
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,2a,3,4,5-Hexahydroacenaphthylen-1-ol. With a topological polar surface area (TPSA) of 20.2 Ų, 1,2,2a,3,4,5-Hexahydroacenaphthylen-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,2a,3,4,5-Hexahydroacenaphthylen-1-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 1,2,2a,3,4,5-Hexahydroacenaphthylen-1-ol?
The CAS number of 1,2,2a,3,4,5-Hexahydroacenaphthylen-1-ol is 16979-06-9.
What is the molecular formula of 1,2,2a,3,4,5-Hexahydroacenaphthylen-1-ol?
The molecular formula of 1,2,2a,3,4,5-Hexahydroacenaphthylen-1-ol is C12H14O.
What is the molecular weight of 1,2,2a,3,4,5-Hexahydroacenaphthylen-1-ol?
The molecular weight of 1,2,2a,3,4,5-Hexahydroacenaphthylen-1-ol is 174.10 g/mol.
Where can I buy 1,2,2a,3,4,5-Hexahydroacenaphthylen-1-ol?
You can request a quote for 1,2,2a,3,4,5-Hexahydroacenaphthylen-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,2a,3,4,5-Hexahydroacenaphthylen-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 1,2,2a,3,4,5-Hexahydroacenaphthylen-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.