3-(1,1,2,3,3,3-Hexafluoropropyl)adamantane-1-carboxylic acid
TL;DR: 3-(1,1,2,3,3,3-Hexafluoropropyl)adamantane-1-carboxylic acid (CAS 86301-98-6) is a chemical compound with molecular formula C14H16F6O2 and molecular weight 330.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,1,2,3,3,3-hexafluoropropyl)adamantane-1-carboxylic acid
Also Known As: 3-(1,1,2,3,3,3-hexafluoropropyl)adamantane-1-carboxylic acid, Maybridge1_007089, 3-FLUORO-2-METHOXY-PHENYL-HYDRAZINE, 3-(2H-Perfluoropropyl)adamantane-1-carboxylic acid, BRD-A34215961-001-01-6
| Molecular Formula | C14H16F6O2 |
|---|---|
| Molecular Weight | 330.11 g/mol |
| LogP | 4.1933 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 330.10544 |
| Heavy Atoms | 22 |
| Complexity | 486.05176 |
Chemical Identifiers
| CAS Number | 86301-98-6 |
|---|---|
| SMILES | C1C2CC3(CC1CC(C2)(C3)C(C(C(F)(F)F)F)(F)F)C(=O)O |
Product Overview
3-(1,1,2,3,3,3-Hexafluoropropyl)adamantane-1-carboxylic acid (CAS 86301-98-6), with molecular formula C14H16F6O2 and molecular weight 330.11 g/mol. IUPAC: 3-(1,1,2,3,3,3-hexafluoropropyl)adamantane-1-carboxylic acid.
Chemical Property Profile of 3-(1,1,2,3,3,3-Hexafluoropropyl)adamantane-1-carboxylic acid
Property Insights of 3-(1,1,2,3,3,3-Hexafluoropropyl)adamantane-1-carboxylic acid
The XLogP value of 4.1933 indicates that 3-(1,1,2,3,3,3-Hexafluoropropyl)adamantane-1-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 3-(1,1,2,3,3,3-Hexafluoropropyl)adamantane-1-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1,1,2,3,3,3-Hexafluoropropyl)adamantane-1-carboxylic acid 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 3-(1,1,2,3,3,3-Hexafluoropropyl)adamantane-1-carboxylic acid?
The CAS number of 3-(1,1,2,3,3,3-Hexafluoropropyl)adamantane-1-carboxylic acid is 86301-98-6.
What is the molecular formula of 3-(1,1,2,3,3,3-Hexafluoropropyl)adamantane-1-carboxylic acid?
The molecular formula of 3-(1,1,2,3,3,3-Hexafluoropropyl)adamantane-1-carboxylic acid is C14H16F6O2.
What is the molecular weight of 3-(1,1,2,3,3,3-Hexafluoropropyl)adamantane-1-carboxylic acid?
The molecular weight of 3-(1,1,2,3,3,3-Hexafluoropropyl)adamantane-1-carboxylic acid is 330.11 g/mol.
Where can I buy 3-(1,1,2,3,3,3-Hexafluoropropyl)adamantane-1-carboxylic acid?
You can request a quote for 3-(1,1,2,3,3,3-Hexafluoropropyl)adamantane-1-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1,1,2,3,3,3-Hexafluoropropyl)adamantane-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(1,1,2,3,3,3-Hexafluoropropyl)adamantane-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.