1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one
TL;DR: 1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one (CAS 54547-81-8) is a chemical compound with molecular formula C28H38O and molecular weight 390.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(7-hexyl-9,10-dihydrophenanthren-2-yl)octan-1-one
Also Known As: EINECS 259-213-4, 1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one, 1-(7-hexyl-9,10-dihydrophenanthren-2-yl)octan-1-one, 1-Octanone,1-(7-hexyl-9,10-dihydro-2-phenanthrenyl)-, 1-(7-Hexyl-9,10-dihydro-phenanthren-2-yl)-octan-1-one
| Molecular Formula | C28H38O |
|---|---|
| Molecular Weight | 390.29 g/mol |
| LogP | 8.1182 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 12 |
| Exact Mass | 390.29227 |
| Heavy Atoms | 29 |
| Complexity | 801.9563 |
Chemical Identifiers
| CAS Number | 54547-81-8 |
|---|---|
| SMILES | CCCCCCCC(=O)C1=CC2=C(C=C1)C3=C(CC2)C=C(C=C3)CCCCCC |
Product Overview
1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one (CAS 54547-81-8), with molecular formula C28H38O and molecular weight 390.29 g/mol. IUPAC: 1-(7-hexyl-9,10-dihydrophenanthren-2-yl)octan-1-one.
Chemical Property Profile of 1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one
Property Insights of 1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one
The XLogP value of 8.1182 indicates that 1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one?
The CAS number of 1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one is 54547-81-8.
What is the molecular formula of 1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one?
The molecular formula of 1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one is C28H38O.
What is the molecular weight of 1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one?
The molecular weight of 1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one is 390.29 g/mol.
Where can I buy 1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one?
You can request a quote for 1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(7-Hexyl-9,10-dihydro-2-phenanthryl)octan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.