1,3-Dichloro-2-(methoxymethyl)benzene
TL;DR: 1,3-Dichloro-2-(methoxymethyl)benzene (CAS 33486-90-7) is a chemical compound with molecular formula C8H8Cl2O and molecular weight 190.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dichloro-2-(methoxymethyl)benzene
Also Known As: 1,3-Dichloro-2-(methoxymethyl)benzene, 2,6-Dichlorobenzyl methyl ether, QBKBHXIQLAMKOB-UHFFFAOYSA-, 2,6-Dichlorobenzylmethyl ether, 2.6-Dichlor-1-acetonyl-benzol
| Molecular Formula | C8H8Cl2O |
|---|---|
| Molecular Weight | 190.00 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 189.99522 |
| Heavy Atoms | 11 |
| Complexity | 109.0 |
Chemical Identifiers
| CAS Number | 33486-90-7 |
|---|---|
| SMILES | COCC1=C(C=CC=C1Cl)Cl |
| InChIKey | QBKBHXIQLAMKOB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Dichloro-2-(methoxymethyl)benzene (CAS 33486-90-7), with molecular formula C8H8Cl2O and molecular weight 190.00 g/mol. IUPAC: 1,3-dichloro-2-(methoxymethyl)benzene.
Chemical Property Profile of 1,3-Dichloro-2-(methoxymethyl)benzene
Property Insights of 1,3-Dichloro-2-(methoxymethyl)benzene
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dichloro-2-(methoxymethyl)benzene. With a topological polar surface area (TPSA) of 9.2 Ų, 1,3-Dichloro-2-(methoxymethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dichloro-2-(methoxymethyl)benzene 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 1,3-Dichloro-2-(methoxymethyl)benzene?
The CAS number of 1,3-Dichloro-2-(methoxymethyl)benzene is 33486-90-7.
What is the molecular formula of 1,3-Dichloro-2-(methoxymethyl)benzene?
The molecular formula of 1,3-Dichloro-2-(methoxymethyl)benzene is C8H8Cl2O.
What is the molecular weight of 1,3-Dichloro-2-(methoxymethyl)benzene?
The molecular weight of 1,3-Dichloro-2-(methoxymethyl)benzene is 190.00 g/mol.
Where can I buy 1,3-Dichloro-2-(methoxymethyl)benzene?
You can request a quote for 1,3-Dichloro-2-(methoxymethyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dichloro-2-(methoxymethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dichloro-2-(methoxymethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.