6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮
TL;DR: 6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮 (CAS 144298-62-4) is a chemical compound with molecular formula C16H13BrO2 and molecular weight 316.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮
6-(bromomethylidene)-3-naphthalen-1-yloxan-2-one
Also Known As: bromoenol lactone, HELSS, (R)-Bromoenol lactone, (S)-Bromoenol lactone, (6E)-Bromoenol lactone
| Molecular Formula | C16H13BrO2 |
|---|---|
| Molecular Weight | 316.01 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 316.0099 |
| Heavy Atoms | 19 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 144298-62-4 |
|---|---|
| SMILES | C1CC(=CBr)OC(=O)C1C2=CC=CC3=CC=CC=C32 |
| InChIKey | BYUCSFWXCMTYOI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮 (CAS 144298-62-4), with molecular formula C16H13BrO2 and molecular weight 316.01 g/mol. IUPAC: 6-(bromomethylidene)-3-naphthalen-1-yloxan-2-one.
Chemical Property Profile of 6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮
Property Insights of 6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮
The XLogP value of 4.2 indicates that 6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮 has 0 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 6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮?
The CAS number of 6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮 is 144298-62-4.
What is the molecular formula of 6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮?
The molecular formula of 6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮 is C16H13BrO2.
What is the molecular weight of 6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮?
The molecular weight of 6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮 is 316.01 g/mol.
Where can I buy 6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮?
You can request a quote for 6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮?
Yes, KEHONG BIO provides custom synthesis services for 6-(溴亚甲基)四氢-3-(1-萘基)-2H-吡喃-2-酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.