2-(1-Adamantyl)propanol
TL;DR: 2-(1-Adamantyl)propanol (CAS 31685-38-8) 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.
3-(1-adamantyl)propan-1-ol
Also Known As: 3-(1-adamantyl)propan-1-ol, 2-(1-Adamantyl)propanol, 3-(1-adamantyl)propanol, 3-(ADAMANTAN-1-YL)PROPAN-1-OL, 2-(1-adamantyl)propan-1-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 | 3 |
| Exact Mass | 194.16707 |
| Heavy Atoms | 14 |
| Complexity | 180.0 |
Chemical Identifiers
| CAS Number | 31685-38-8 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)CCCO |
| InChIKey | ASRLPYUFROGXNU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(1-Adamantyl)propanol (CAS 31685-38-8), with molecular formula C13H22O and molecular weight 194.17 g/mol. IUPAC: 3-(1-adamantyl)propan-1-ol.
Chemical Property Profile of 2-(1-Adamantyl)propanol
Property Insights of 2-(1-Adamantyl)propanol
The XLogP value of 3.7 indicates that 2-(1-Adamantyl)propanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 2-(1-Adamantyl)propanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1-Adamantyl)propanol 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 2-(1-Adamantyl)propanol?
The CAS number of 2-(1-Adamantyl)propanol is 31685-38-8.
What is the molecular formula of 2-(1-Adamantyl)propanol?
The molecular formula of 2-(1-Adamantyl)propanol is C13H22O.
What is the molecular weight of 2-(1-Adamantyl)propanol?
The molecular weight of 2-(1-Adamantyl)propanol is 194.17 g/mol.
Where can I buy 2-(1-Adamantyl)propanol?
You can request a quote for 2-(1-Adamantyl)propanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1-Adamantyl)propanol?
Yes, KEHONG BIO provides custom synthesis services for 2-(1-Adamantyl)propanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.