4-氯苯基甲基亚砜
TL;DR: 4-氯苯基甲基亚砜 (CAS 934-73-6) is a chemical compound with molecular formula C7H7ClOS and molecular weight 173.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氯苯基甲基亚砜
1-chloro-4-methylsulfinylbenzene
Also Known As: p-Chlorophenyl methyl sulfoxide, 1-Chloro-4-(methylsulfinyl)benzene, 4-Chlorophenyl methyl sulfoxide, Methyl 4-chlorophenyl sulfoxide, 1-chloro-4-methylsulfinylbenzene
| Molecular Formula | C7H7ClOS |
|---|---|
| Molecular Weight | 173.99 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 173.99062 |
| Heavy Atoms | 10 |
| Complexity | 130.0 |
Chemical Identifiers
| CAS Number | 934-73-6 |
|---|---|
| SMILES | CS(=O)C1=CC=C(C=C1)Cl |
| InChIKey | UBDUBBTYCRJUHW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-氯苯基甲基亚砜 (CAS 934-73-6), with molecular formula C7H7ClOS and molecular weight 173.99 g/mol. IUPAC: 1-chloro-4-methylsulfinylbenzene.
Chemical Property Profile of 4-氯苯基甲基亚砜
Property Insights of 4-氯苯基甲基亚砜
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-氯苯基甲基亚砜. With a topological polar surface area (TPSA) of 36.3 Ų, 4-氯苯基甲基亚砜 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-氯苯基甲基亚砜 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 4-氯苯基甲基亚砜?
The CAS number of 4-氯苯基甲基亚砜 is 934-73-6.
What is the molecular formula of 4-氯苯基甲基亚砜?
The molecular formula of 4-氯苯基甲基亚砜 is C7H7ClOS.
What is the molecular weight of 4-氯苯基甲基亚砜?
The molecular weight of 4-氯苯基甲基亚砜 is 173.99 g/mol.
Where can I buy 4-氯苯基甲基亚砜?
You can request a quote for 4-氯苯基甲基亚砜 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氯苯基甲基亚砜?
Yes, KEHONG BIO provides custom synthesis services for 4-氯苯基甲基亚砜 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.