2-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl-
TL;DR: 2-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl- (CAS 643-53-8) 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.
2,5,5-trimethyl-3,4,4a,6,7,8-hexahydronaphthalen-2-ol
Also Known As: 2-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl-, 2,5,5-trimethyl-3,4,4a,6,7,8-hexahydronaphthalen-2-ol, 2,3,4,4a,5,6,7,8-Octahydro-2,5,5-trimethyl-2-naphthol, 2,5,5-trimethyl-2,3,4,4a,5,6,7,8-octahydronaphthalen-2-ol, 2-Naphthol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl-
| Molecular Formula | C13H22O |
|---|---|
| Molecular Weight | 194.17 g/mol |
| LogP | 2.8 |
| 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 | 264.0 |
Chemical Identifiers
| CAS Number | 643-53-8 |
|---|---|
| SMILES | CC1(CCCC2=CC(CCC21)(C)O)C |
| InChIKey | BJYVIXDQQRDHDI-UHFFFAOYSA-N |
Product Overview
2-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl- (CAS 643-53-8), with molecular formula C13H22O and molecular weight 194.17 g/mol. IUPAC: 2,5,5-trimethyl-3,4,4a,6,7,8-hexahydronaphthalen-2-ol.
Chemical Property Profile of 2-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl-
Property Insights of 2-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl-
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl-. With a topological polar surface area (TPSA) of 20.2 Ų, 2-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl- 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-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl-?
The CAS number of 2-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl- is 643-53-8.
What is the molecular formula of 2-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl-?
The molecular formula of 2-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl- is C13H22O.
What is the molecular weight of 2-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl-?
The molecular weight of 2-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl- is 194.17 g/mol.
Where can I buy 2-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl-?
You can request a quote for 2-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Naphthalenol, 2,3,4,4a,5,6,7,8-octahydro-2,5,5-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.