1-((Methylthio)methyl)naphthalene
TL;DR: 1-((Methylthio)methyl)naphthalene (CAS 5925-60-0) is a chemical compound with molecular formula C12H12S and molecular weight 188.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(methylsulfanylmethyl)naphthalene
Also Known As: methyl 1-naphthylmethyl sulfide, methylthionaphthylmethane, 1-[(Methylthio)methyl]naphthalene, 1-(methylsulfanylmethyl)naphthalene, 1-Methylsulfanylmethyl-naphthalene
| Molecular Formula | C12H12S |
|---|---|
| Molecular Weight | 188.07 g/mol |
| LogP | 3.7028 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 188.06598 |
| Heavy Atoms | 13 |
| Complexity | 401.2897 |
Chemical Identifiers
| CAS Number | 5925-60-0 |
|---|---|
| SMILES | CSCC1=CC=CC2=CC=CC=C21 |
Product Overview
1-((Methylthio)methyl)naphthalene (CAS 5925-60-0), with molecular formula C12H12S and molecular weight 188.07 g/mol. IUPAC: 1-(methylsulfanylmethyl)naphthalene.
Chemical Property Profile of 1-((Methylthio)methyl)naphthalene
Property Insights of 1-((Methylthio)methyl)naphthalene
The XLogP value of 3.7028 indicates that 1-((Methylthio)methyl)naphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1-((Methylthio)methyl)naphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-((Methylthio)methyl)naphthalene 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-((Methylthio)methyl)naphthalene?
The CAS number of 1-((Methylthio)methyl)naphthalene is 5925-60-0.
What is the molecular formula of 1-((Methylthio)methyl)naphthalene?
The molecular formula of 1-((Methylthio)methyl)naphthalene is C12H12S.
What is the molecular weight of 1-((Methylthio)methyl)naphthalene?
The molecular weight of 1-((Methylthio)methyl)naphthalene is 188.07 g/mol.
Where can I buy 1-((Methylthio)methyl)naphthalene?
You can request a quote for 1-((Methylthio)methyl)naphthalene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((Methylthio)methyl)naphthalene?
Yes, KEHONG BIO provides custom synthesis services for 1-((Methylthio)methyl)naphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.