1,1,3,3,7-Pentamethylindan-5-ol
TL;DR: 1,1,3,3,7-Pentamethylindan-5-ol (CAS 53718-29-9) is a chemical compound with molecular formula C14H20O and molecular weight 204.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,3,3,7-pentamethyl-2H-inden-5-ol
Also Known As: 1,1,3,3,7-Pentamethylindan-5-ol, 1,1,3,3,7-pentamethyl-2H-inden-5-ol, 1,1,3,3,7-pentamethyl-2,3-dihydro-1H-inden-5-ol, 2,3-Dihydro-1,1,3,3,7-pentamethyl-1H-inden-5-ol, 1H-Inden-5-ol,2,3-dihydro-1,1,3,3,7-pentamethyl-
| Molecular Formula | C14H20O |
|---|---|
| Molecular Weight | 204.15 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 204.15141 |
| Heavy Atoms | 15 |
| Complexity | 254.0 |
Chemical Identifiers
| CAS Number | 53718-29-9 |
|---|---|
| SMILES | CC1=CC(=CC2=C1C(CC2(C)C)(C)C)O |
| InChIKey | YUORWRHMCJCLRK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1,3,3,7-Pentamethylindan-5-ol (CAS 53718-29-9), with molecular formula C14H20O and molecular weight 204.15 g/mol. IUPAC: 1,1,3,3,7-pentamethyl-2H-inden-5-ol.
Chemical Property Profile of 1,1,3,3,7-Pentamethylindan-5-ol
Property Insights of 1,1,3,3,7-Pentamethylindan-5-ol
The XLogP value of 4.5 indicates that 1,1,3,3,7-Pentamethylindan-5-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, 1,1,3,3,7-Pentamethylindan-5-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,3,3,7-Pentamethylindan-5-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 1,1,3,3,7-Pentamethylindan-5-ol?
The CAS number of 1,1,3,3,7-Pentamethylindan-5-ol is 53718-29-9.
What is the molecular formula of 1,1,3,3,7-Pentamethylindan-5-ol?
The molecular formula of 1,1,3,3,7-Pentamethylindan-5-ol is C14H20O.
What is the molecular weight of 1,1,3,3,7-Pentamethylindan-5-ol?
The molecular weight of 1,1,3,3,7-Pentamethylindan-5-ol is 204.15 g/mol.
Where can I buy 1,1,3,3,7-Pentamethylindan-5-ol?
You can request a quote for 1,1,3,3,7-Pentamethylindan-5-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,3,3,7-Pentamethylindan-5-ol?
Yes, KEHONG BIO provides custom synthesis services for 1,1,3,3,7-Pentamethylindan-5-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.