Decahydro-1h-phenalen-3a(4h)-ol
TL;DR: Decahydro-1h-phenalen-3a(4h)-ol (CAS 27553-53-3) is a chemical compound with molecular formula C13H22O and molecular weight 194.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,3,4,5,6,6a,7,8,9,9a,9b-dodecahydrophenalen-3a-ol
Also Known As: decahydro-1h-phenalen-3a(4h)-ol, 1,2,3,4,5,6,6a,7,8,9,9a,9b-dodecahydrophenalen-3a-ol
| Molecular Formula | C13H22O |
|---|---|
| Molecular Weight | 194.17 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 194.16707 |
| Heavy Atoms | 14 |
| Complexity | 205.0 |
Chemical Identifiers
| CAS Number | 27553-53-3 |
|---|---|
| SMILES | C1CC2CCCC3(C2C(C1)CCC3)O |
| InChIKey | MEAXTQFQUBQGLJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Decahydro-1h-phenalen-3a(4h)-ol (CAS 27553-53-3), with molecular formula C13H22O and molecular weight 194.17 g/mol. IUPAC: 1,2,3,4,5,6,6a,7,8,9,9a,9b-dodecahydrophenalen-3a-ol.
Chemical Property Profile of Decahydro-1h-phenalen-3a(4h)-ol
Property Insights of Decahydro-1h-phenalen-3a(4h)-ol
The XLogP value of 3.7 indicates that Decahydro-1h-phenalen-3a(4h)-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, Decahydro-1h-phenalen-3a(4h)-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Decahydro-1h-phenalen-3a(4h)-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 Decahydro-1h-phenalen-3a(4h)-ol?
The CAS number of Decahydro-1h-phenalen-3a(4h)-ol is 27553-53-3.
What is the molecular formula of Decahydro-1h-phenalen-3a(4h)-ol?
The molecular formula of Decahydro-1h-phenalen-3a(4h)-ol is C13H22O.
What is the molecular weight of Decahydro-1h-phenalen-3a(4h)-ol?
The molecular weight of Decahydro-1h-phenalen-3a(4h)-ol is 194.17 g/mol.
Where can I buy Decahydro-1h-phenalen-3a(4h)-ol?
You can request a quote for Decahydro-1h-phenalen-3a(4h)-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Decahydro-1h-phenalen-3a(4h)-ol?
Yes, KEHONG BIO provides custom synthesis services for Decahydro-1h-phenalen-3a(4h)-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.