9-Anthracenylmethyl methyl sulfide
TL;DR: 9-Anthracenylmethyl methyl sulfide (CAS 61574-53-6) is a chemical compound with molecular formula C16H14S and molecular weight 238.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(methylsulfanylmethyl)anthracene
Also Known As: 9-anthracenylmethyl, 9-anthracenylmethyl methyl sulfide, BIDD:GT0672, 9-(Methylthiomethyl)anthracene, 9-(methylsulfanylmethyl)anthracene
| Molecular Formula | C16H14S |
|---|---|
| Molecular Weight | 238.08 g/mol |
| LogP | 4.856 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 238.08162 |
| Heavy Atoms | 17 |
| Complexity | 616.49335 |
Chemical Identifiers
| CAS Number | 61574-53-6 |
|---|---|
| SMILES | CSCC1=C2C=CC=CC2=CC3=CC=CC=C31 |
Product Overview
9-Anthracenylmethyl methyl sulfide (CAS 61574-53-6), with molecular formula C16H14S and molecular weight 238.08 g/mol. IUPAC: 9-(methylsulfanylmethyl)anthracene.
Chemical Property Profile of 9-Anthracenylmethyl methyl sulfide
Property Insights of 9-Anthracenylmethyl methyl sulfide
The XLogP value of 4.856 indicates that 9-Anthracenylmethyl methyl sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 9-Anthracenylmethyl methyl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-Anthracenylmethyl methyl sulfide 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 9-Anthracenylmethyl methyl sulfide?
The CAS number of 9-Anthracenylmethyl methyl sulfide is 61574-53-6.
What is the molecular formula of 9-Anthracenylmethyl methyl sulfide?
The molecular formula of 9-Anthracenylmethyl methyl sulfide is C16H14S.
What is the molecular weight of 9-Anthracenylmethyl methyl sulfide?
The molecular weight of 9-Anthracenylmethyl methyl sulfide is 238.08 g/mol.
Where can I buy 9-Anthracenylmethyl methyl sulfide?
You can request a quote for 9-Anthracenylmethyl methyl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Anthracenylmethyl methyl sulfide?
Yes, KEHONG BIO provides custom synthesis services for 9-Anthracenylmethyl methyl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.