Naphthalene, 2,6-bis(methylthio)-
TL;DR: Naphthalene, 2,6-bis(methylthio)- (CAS 10075-77-1) is a chemical compound with molecular formula C12H12S2 and molecular weight 220.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-bis(methylsulfanyl)naphthalene
Also Known As: 2,6-Bis(methylthio)naphthalene, 2,6-bis(methylsulfanyl)naphthalene, 2,6-Bis-(methylthio)naphthalene, Naphthalene, 2,6-bis(methylthio)-, Naphthalene,2,6-bis(methylthio)-
| Molecular Formula | C12H12S2 |
|---|---|
| Molecular Weight | 220.04 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 220.03804 |
| Heavy Atoms | 14 |
| Complexity | 161.0 |
Chemical Identifiers
| CAS Number | 10075-77-1 |
|---|---|
| SMILES | CSC1=CC2=C(C=C1)C=C(C=C2)SC |
| InChIKey | KRDUPYZJDYFJOC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Naphthalene, 2,6-bis(methylthio)- (CAS 10075-77-1), with molecular formula C12H12S2 and molecular weight 220.04 g/mol. IUPAC: 2,6-bis(methylsulfanyl)naphthalene.
Chemical Property Profile of Naphthalene, 2,6-bis(methylthio)-
Property Insights of Naphthalene, 2,6-bis(methylthio)-
The XLogP value of 4.2 indicates that Naphthalene, 2,6-bis(methylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, Naphthalene, 2,6-bis(methylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Naphthalene, 2,6-bis(methylthio)- 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 Naphthalene, 2,6-bis(methylthio)-?
The CAS number of Naphthalene, 2,6-bis(methylthio)- is 10075-77-1.
What is the molecular formula of Naphthalene, 2,6-bis(methylthio)-?
The molecular formula of Naphthalene, 2,6-bis(methylthio)- is C12H12S2.
What is the molecular weight of Naphthalene, 2,6-bis(methylthio)-?
The molecular weight of Naphthalene, 2,6-bis(methylthio)- is 220.04 g/mol.
Where can I buy Naphthalene, 2,6-bis(methylthio)-?
You can request a quote for Naphthalene, 2,6-bis(methylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Naphthalene, 2,6-bis(methylthio)-?
Yes, KEHONG BIO provides custom synthesis services for Naphthalene, 2,6-bis(methylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.