7-Hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one
TL;DR: 7-Hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one (CAS 7466-87-7) is a chemical compound with molecular formula C10H14O2 and molecular weight 166.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one
Also Known As: 7-hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one
| Molecular Formula | C10H14O2 |
|---|---|
| Molecular Weight | 166.10 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 166.09938 |
| Heavy Atoms | 12 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 7466-87-7 |
|---|---|
| SMILES | CC1=CC=CC(C(C1=O)O)(C)C |
| InChIKey | OFIUMPASHSRETN-UHFFFAOYSA-N |
Product Overview
7-Hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one (CAS 7466-87-7), with molecular formula C10H14O2 and molecular weight 166.10 g/mol. IUPAC: 7-hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one.
Chemical Property Profile of 7-Hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one
Property Insights of 7-Hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one. With a topological polar surface area (TPSA) of 37.3 Ų, 7-Hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one has 1 hydrogen bond donor(s) and 2 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 7-Hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one?
The CAS number of 7-Hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one is 7466-87-7.
What is the molecular formula of 7-Hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one?
The molecular formula of 7-Hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one is C10H14O2.
What is the molecular weight of 7-Hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one?
The molecular weight of 7-Hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one is 166.10 g/mol.
Where can I buy 7-Hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one?
You can request a quote for 7-Hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-Hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one?
Yes, KEHONG BIO provides custom synthesis services for 7-Hydroxy-2,6,6-trimethylcyclohepta-2,4-dien-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.