1-四氢萘酮
TL;DR: 1-四氢萘酮 (CAS 529-34-0) is a chemical compound with molecular formula C10H10O and molecular weight 146.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-四氢萘酮
3,4-dihydro-2H-naphthalen-1-one
Also Known As: 1-TETRALONE, alpha-Tetralone, tetralone, 3,4-dihydronaphthalen-1(2H)-one, a-Tetralone
| Molecular Formula | C10H10O |
|---|---|
| Molecular Weight | 146.07 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 146.07317 |
| Heavy Atoms | 11 |
| Complexity | 162.0 |
| Melting Point | 8 °C |
| Boiling Point | 255-257 °C @ 760 MM HG |
| Density | 1.0988 @ 16 °C |
| Solubility | INSOL IN WATER |
| Flash Point | 129 °C |
| Vapor Pressure | 0.01 [mmHg] |
| Refractive Index | 1.5672 @ 20 °C; MAX ABSORPTION (HEXANE): 247.5 NM (LOG E= 4.06); 290 NM (LOG E= 3.28) |
Chemical Identifiers
| CAS Number | 529-34-0 |
|---|---|
| SMILES | C1CC2=CC=CC=C2C(=O)C1 |
| InChIKey | XHLHPRDBBAGVEG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-四氢萘酮 (CAS 529-34-0), with molecular formula C10H10O and molecular weight 146.07 g/mol. IUPAC: 3,4-dihydro-2H-naphthalen-1-one.
Chemical Property Profile of 1-四氢萘酮
Property Insights of 1-四氢萘酮
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-四氢萘酮. With a topological polar surface area (TPSA) of 17.1 Ų, 1-四氢萘酮 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-四氢萘酮 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 1-四氢萘酮?
The CAS number of 1-四氢萘酮 is 529-34-0.
What is the molecular formula of 1-四氢萘酮?
The molecular formula of 1-四氢萘酮 is C10H10O.
What is the molecular weight of 1-四氢萘酮?
The molecular weight of 1-四氢萘酮 is 146.07 g/mol.
Where can I buy 1-四氢萘酮?
You can request a quote for 1-四氢萘酮 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-四氢萘酮?
Yes, KEHONG BIO provides custom synthesis services for 1-四氢萘酮 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.