3,5-Dichloroanisole
TL;DR: 3,5-Dichloroanisole (CAS 33719-74-3) is a chemical compound with molecular formula C7H6Cl2O and molecular weight 175.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dichloro-5-methoxybenzene
Also Known As: 3,5-Dichloroanisole, 1,3-Dichloro-5-methoxybenzene, 2-Bromoresorcinol, 3,5-dichloro anisole, 3,5-dichloro-anisole
| Molecular Formula | C7H6Cl2O |
|---|---|
| Molecular Weight | 175.98 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 175.97957 |
| Heavy Atoms | 10 |
| Complexity | 97.0 |
| Vapor Pressure | 0.16 [mmHg] |
Chemical Identifiers
| CAS Number | 33719-74-3 |
|---|---|
| SMILES | COC1=CC(=CC(=C1)Cl)Cl |
| InChIKey | SSNXYMVLSOMJLU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-Dichloroanisole (CAS 33719-74-3), with molecular formula C7H6Cl2O and molecular weight 175.98 g/mol. IUPAC: 1,3-dichloro-5-methoxybenzene.
Chemical Property Profile of 3,5-Dichloroanisole
Property Insights of 3,5-Dichloroanisole
The XLogP value of 3.8 indicates that 3,5-Dichloroanisole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 3,5-Dichloroanisole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Dichloroanisole 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 3,5-Dichloroanisole?
The CAS number of 3,5-Dichloroanisole is 33719-74-3.
What is the molecular formula of 3,5-Dichloroanisole?
The molecular formula of 3,5-Dichloroanisole is C7H6Cl2O.
What is the molecular weight of 3,5-Dichloroanisole?
The molecular weight of 3,5-Dichloroanisole is 175.98 g/mol.
Where can I buy 3,5-Dichloroanisole?
You can request a quote for 3,5-Dichloroanisole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dichloroanisole?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dichloroanisole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.