2,7-Dimethylnaphthalene
TL;DR: 2,7-Dimethylnaphthalene (CAS 582-16-1) is a chemical compound with molecular formula C12H12 and molecular weight 156.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,7-dimethylnaphthalene
Also Known As: 2,7-DIMETHYLNAPHTHALENE, Naphthalene, 2,7-dimethyl-, 2,7-dimethyl-naphthalene, m-Tolylurea, 27-Dimethylnaphthalene
| Molecular Formula | C12H12 |
|---|---|
| Molecular Weight | 156.09 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 156.0939 |
| Heavy Atoms | 12 |
| Complexity | 134.0 |
Chemical Identifiers
| CAS Number | 582-16-1 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)C=CC(=C2)C |
| InChIKey | LRQYSMQNJLZKPS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,7-Dimethylnaphthalene (CAS 582-16-1), with molecular formula C12H12 and molecular weight 156.09 g/mol. IUPAC: 2,7-dimethylnaphthalene.
Chemical Property Profile of 2,7-Dimethylnaphthalene
Property Insights of 2,7-Dimethylnaphthalene
The XLogP value of 4.3 indicates that 2,7-Dimethylnaphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2,7-Dimethylnaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,7-Dimethylnaphthalene has 0 hydrogen bond donor(s) and 0 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 2,7-Dimethylnaphthalene?
The CAS number of 2,7-Dimethylnaphthalene is 582-16-1.
What is the molecular formula of 2,7-Dimethylnaphthalene?
The molecular formula of 2,7-Dimethylnaphthalene is C12H12.
What is the molecular weight of 2,7-Dimethylnaphthalene?
The molecular weight of 2,7-Dimethylnaphthalene is 156.09 g/mol.
Where can I buy 2,7-Dimethylnaphthalene?
You can request a quote for 2,7-Dimethylnaphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,7-Dimethylnaphthalene?
Yes, KEHONG BIO provides custom synthesis services for 2,7-Dimethylnaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.