1,5-Diacetylnaphthalene
TL;DR: 1,5-Diacetylnaphthalene (CAS 35345-09-6) is a chemical compound with molecular formula C14H12O2 and molecular weight 212.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-acetylnaphthalen-1-yl)ethanone
Also Known As: 1,5-Diacetylnaphthalene, 1-(5-acetylnaphthalen-1-yl)ethanone, 1,5-Diacetyl-naphthalin, 1,1'-(Naphthalene-1,5-diyl)diethanone, 1-(5-acetylnaphthalen-1-yl)ethan-1-one
| Molecular Formula | C14H12O2 |
|---|---|
| Molecular Weight | 212.08 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 212.08372 |
| Heavy Atoms | 16 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 35345-09-6 |
|---|---|
| SMILES | CC(=O)C1=CC=CC2=C1C=CC=C2C(=O)C |
| InChIKey | XWZKPVAYNUXKCZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,5-Diacetylnaphthalene (CAS 35345-09-6), with molecular formula C14H12O2 and molecular weight 212.08 g/mol. IUPAC: 1-(5-acetylnaphthalen-1-yl)ethanone.
Chemical Property Profile of 1,5-Diacetylnaphthalene
Property Insights of 1,5-Diacetylnaphthalene
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,5-Diacetylnaphthalene. With a topological polar surface area (TPSA) of 34.1 Ų, 1,5-Diacetylnaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,5-Diacetylnaphthalene 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 1,5-Diacetylnaphthalene?
The CAS number of 1,5-Diacetylnaphthalene is 35345-09-6.
What is the molecular formula of 1,5-Diacetylnaphthalene?
The molecular formula of 1,5-Diacetylnaphthalene is C14H12O2.
What is the molecular weight of 1,5-Diacetylnaphthalene?
The molecular weight of 1,5-Diacetylnaphthalene is 212.08 g/mol.
Where can I buy 1,5-Diacetylnaphthalene?
You can request a quote for 1,5-Diacetylnaphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-Diacetylnaphthalene?
Yes, KEHONG BIO provides custom synthesis services for 1,5-Diacetylnaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.