1-Butanone, 1-(9-phenanthrenyl)-
TL;DR: 1-Butanone, 1-(9-phenanthrenyl)- (CAS 646450-30-8) is a chemical compound with molecular formula C18H16O and molecular weight 248.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-phenanthren-9-ylbutan-1-one
Also Known As: 1-Butanone, 1-(9-phenanthrenyl)-, 1-phenanthren-9-ylbutan-1-one, 1,3-Benzenediol,5-docosyl, 1-(9-Phenanthrenyl)-1-butanone, 1-PHENANTHREN-9-YL-BUTAN-1-ONE
| Molecular Formula | C18H16O |
|---|---|
| Molecular Weight | 248.12 g/mol |
| LogP | 4.9758 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.12012 |
| Heavy Atoms | 19 |
| Complexity | 755.8286 |
Chemical Identifiers
| CAS Number | 646450-30-8 |
|---|---|
| SMILES | CCCC(=O)C1=CC2=CC=CC=C2C3=CC=CC=C31 |
Product Overview
1-Butanone, 1-(9-phenanthrenyl)- (CAS 646450-30-8), with molecular formula C18H16O and molecular weight 248.12 g/mol. IUPAC: 1-phenanthren-9-ylbutan-1-one.
Chemical Property Profile of 1-Butanone, 1-(9-phenanthrenyl)-
Property Insights of 1-Butanone, 1-(9-phenanthrenyl)-
The XLogP value of 4.9758 indicates that 1-Butanone, 1-(9-phenanthrenyl)- 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-Butanone, 1-(9-phenanthrenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butanone, 1-(9-phenanthrenyl)- has 0 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 1-Butanone, 1-(9-phenanthrenyl)-?
The CAS number of 1-Butanone, 1-(9-phenanthrenyl)- is 646450-30-8.
What is the molecular formula of 1-Butanone, 1-(9-phenanthrenyl)-?
The molecular formula of 1-Butanone, 1-(9-phenanthrenyl)- is C18H16O.
What is the molecular weight of 1-Butanone, 1-(9-phenanthrenyl)-?
The molecular weight of 1-Butanone, 1-(9-phenanthrenyl)- is 248.12 g/mol.
Where can I buy 1-Butanone, 1-(9-phenanthrenyl)-?
You can request a quote for 1-Butanone, 1-(9-phenanthrenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butanone, 1-(9-phenanthrenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1-Butanone, 1-(9-phenanthrenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.