1-(Methylsulfinyl)-4-methoxybenzene
TL;DR: 1-(Methylsulfinyl)-4-methoxybenzene (CAS 3517-99-5) is a chemical compound with molecular formula C8H10O2S and molecular weight 170.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methoxy-4-methylsulfinylbenzene
Also Known As: 1-methoxy-4-(methylsulfinyl)benzene, 1-(Methylsulfinyl)-4-methoxybenzene, 1-METHANESULFINYL-4-METHOXYBENZENE, 1- -4-methoxybenzene, 1-methoxy-4-methylsulfinylbenzene
| Molecular Formula | C8H10O2S |
|---|---|
| Molecular Weight | 170.04 g/mol |
| LogP | 1.4326 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 170.04015 |
| Heavy Atoms | 11 |
| Complexity | 253.2995 |
Chemical Identifiers
| CAS Number | 3517-99-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)S(=O)C |
Product Overview
1-(Methylsulfinyl)-4-methoxybenzene (CAS 3517-99-5), with molecular formula C8H10O2S and molecular weight 170.04 g/mol. IUPAC: 1-methoxy-4-methylsulfinylbenzene.
Chemical Property Profile of 1-(Methylsulfinyl)-4-methoxybenzene
Property Insights of 1-(Methylsulfinyl)-4-methoxybenzene
The XLogP value of 1.4326 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Methylsulfinyl)-4-methoxybenzene. With a topological polar surface area (TPSA) of 26.3 Ų, 1-(Methylsulfinyl)-4-methoxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Methylsulfinyl)-4-methoxybenzene 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-(Methylsulfinyl)-4-methoxybenzene?
The CAS number of 1-(Methylsulfinyl)-4-methoxybenzene is 3517-99-5.
What is the molecular formula of 1-(Methylsulfinyl)-4-methoxybenzene?
The molecular formula of 1-(Methylsulfinyl)-4-methoxybenzene is C8H10O2S.
What is the molecular weight of 1-(Methylsulfinyl)-4-methoxybenzene?
The molecular weight of 1-(Methylsulfinyl)-4-methoxybenzene is 170.04 g/mol.
Where can I buy 1-(Methylsulfinyl)-4-methoxybenzene?
You can request a quote for 1-(Methylsulfinyl)-4-methoxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Methylsulfinyl)-4-methoxybenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(Methylsulfinyl)-4-methoxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.