2-Chloro-1,3,5-trimethoxybenzene
TL;DR: 2-Chloro-1,3,5-trimethoxybenzene (CAS 67827-56-9) is a chemical compound with molecular formula C9H11ClO3 and molecular weight 202.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-1,3,5-trimethoxybenzene
Also Known As: 2-Chloro-1,3,5-trimethoxybenzene, Benzene,3,5-trimethoxy-, Chlorophloroglucinol trimethyl ether, 2,4,6-trimethoxychlorobenzene, O(C)c1cc(OC)cc(OC)c1Cl
| Molecular Formula | C9H11ClO3 |
|---|---|
| Molecular Weight | 202.04 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 202.03967 |
| Heavy Atoms | 13 |
| Complexity | 140.0 |
Chemical Identifiers
| CAS Number | 67827-56-9 |
|---|---|
| SMILES | COC1=CC(=C(C(=C1)OC)Cl)OC |
| InChIKey | RLLPSYLJYVMSBI-UHFFFAOYSA-N |
Product Overview
2-Chloro-1,3,5-trimethoxybenzene (CAS 67827-56-9), with molecular formula C9H11ClO3 and molecular weight 202.04 g/mol. IUPAC: 2-chloro-1,3,5-trimethoxybenzene.
Chemical Property Profile of 2-Chloro-1,3,5-trimethoxybenzene
Property Insights of 2-Chloro-1,3,5-trimethoxybenzene
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-1,3,5-trimethoxybenzene. With a topological polar surface area (TPSA) of 27.7 Ų, 2-Chloro-1,3,5-trimethoxybenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-1,3,5-trimethoxybenzene has 0 hydrogen bond donor(s) and 3 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 2-Chloro-1,3,5-trimethoxybenzene?
The CAS number of 2-Chloro-1,3,5-trimethoxybenzene is 67827-56-9.
What is the molecular formula of 2-Chloro-1,3,5-trimethoxybenzene?
The molecular formula of 2-Chloro-1,3,5-trimethoxybenzene is C9H11ClO3.
What is the molecular weight of 2-Chloro-1,3,5-trimethoxybenzene?
The molecular weight of 2-Chloro-1,3,5-trimethoxybenzene is 202.04 g/mol.
Where can I buy 2-Chloro-1,3,5-trimethoxybenzene?
You can request a quote for 2-Chloro-1,3,5-trimethoxybenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-1,3,5-trimethoxybenzene?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-1,3,5-trimethoxybenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.