Methanone, (3,4-dihydro-2H-1-benzopyran-6-yl)(4-fluorophenyl)-
TL;DR: Methanone, (3,4-dihydro-2H-1-benzopyran-6-yl)(4-fluorophenyl)- (CAS 59977-81-0) is a chemical compound with molecular formula C16H13FO2 and molecular weight 256.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dihydro-2H-chromen-6-yl-(4-fluorophenyl)methanone
Also Known As: Chroman-6-yl-(4-fluoro-phenyl)-methanone, chroman-6-yl 4-fluorophenyl ketone, 3,4-dihydro-2H-chromen-6-yl-(4-fluorophenyl)methanone, 2H-1-Benzopyran, 3,4-dihydro-6-(p-fluorobenzyl)-, 3,4-dihydro-2H-chromen-6-yl(4-fluorophenyl)methanone
| Molecular Formula | C16H13FO2 |
|---|---|
| Molecular Weight | 256.09 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.08997 |
| Heavy Atoms | 19 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 59977-81-0 |
|---|---|
| SMILES | C1CC2=C(C=CC(=C2)C(=O)C3=CC=C(C=C3)F)OC1 |
| InChIKey | DOXPZDQZYBELDP-UHFFFAOYSA-N |
Product Overview
Methanone, (3,4-dihydro-2H-1-benzopyran-6-yl)(4-fluorophenyl)- (CAS 59977-81-0), with molecular formula C16H13FO2 and molecular weight 256.09 g/mol. IUPAC: 3,4-dihydro-2H-chromen-6-yl-(4-fluorophenyl)methanone.
Chemical Property Profile of Methanone, (3,4-dihydro-2H-1-benzopyran-6-yl)(4-fluorophenyl)-
Property Insights of Methanone, (3,4-dihydro-2H-1-benzopyran-6-yl)(4-fluorophenyl)-
The XLogP value of 3.7 indicates that Methanone, (3,4-dihydro-2H-1-benzopyran-6-yl)(4-fluorophenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Methanone, (3,4-dihydro-2H-1-benzopyran-6-yl)(4-fluorophenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methanone, (3,4-dihydro-2H-1-benzopyran-6-yl)(4-fluorophenyl)- has 0 hydrogen bond donor(s) and 3 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 Methanone, (3,4-dihydro-2H-1-benzopyran-6-yl)(4-fluorophenyl)-?
The CAS number of Methanone, (3,4-dihydro-2H-1-benzopyran-6-yl)(4-fluorophenyl)- is 59977-81-0.
What is the molecular formula of Methanone, (3,4-dihydro-2H-1-benzopyran-6-yl)(4-fluorophenyl)-?
The molecular formula of Methanone, (3,4-dihydro-2H-1-benzopyran-6-yl)(4-fluorophenyl)- is C16H13FO2.
What is the molecular weight of Methanone, (3,4-dihydro-2H-1-benzopyran-6-yl)(4-fluorophenyl)-?
The molecular weight of Methanone, (3,4-dihydro-2H-1-benzopyran-6-yl)(4-fluorophenyl)- is 256.09 g/mol.
Where can I buy Methanone, (3,4-dihydro-2H-1-benzopyran-6-yl)(4-fluorophenyl)-?
You can request a quote for Methanone, (3,4-dihydro-2H-1-benzopyran-6-yl)(4-fluorophenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methanone, (3,4-dihydro-2H-1-benzopyran-6-yl)(4-fluorophenyl)-?
Yes, KEHONG BIO provides custom synthesis services for Methanone, (3,4-dihydro-2H-1-benzopyran-6-yl)(4-fluorophenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.