3-Methoxy-4-methylbenzoyl chloride
TL;DR: 3-Methoxy-4-methylbenzoyl chloride (CAS 87808-44-4) is a chemical compound with molecular formula C9H9ClO2 and molecular weight 184.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methoxy-4-methylbenzoyl chloride
Also Known As: 3-methoxy-4-methylbenzoyl chloride, 3-Methoxy-4-methyl-benzoyl chloride, 3-methoxy-4-methylbenzoylchloride, Benzoyl chloride, 3-methoxy-4-methyl-, 3-METHOXY-4-METHYL BENZOYL CHLORIDE
| Molecular Formula | C9H9ClO2 |
|---|---|
| Molecular Weight | 184.03 g/mol |
| LogP | 2.38262 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 184.02911 |
| Heavy Atoms | 12 |
| Complexity | 307.39688 |
Chemical Identifiers
| CAS Number | 87808-44-4 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)C(=O)Cl)OC |
Product Overview
3-Methoxy-4-methylbenzoyl chloride (CAS 87808-44-4), with molecular formula C9H9ClO2 and molecular weight 184.03 g/mol. IUPAC: 3-methoxy-4-methylbenzoyl chloride.
Chemical Property Profile of 3-Methoxy-4-methylbenzoyl chloride
Property Insights of 3-Methoxy-4-methylbenzoyl chloride
The XLogP value of 2.38262 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methoxy-4-methylbenzoyl chloride. With a topological polar surface area (TPSA) of 26.3 Ų, 3-Methoxy-4-methylbenzoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methoxy-4-methylbenzoyl chloride 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 3-Methoxy-4-methylbenzoyl chloride?
The CAS number of 3-Methoxy-4-methylbenzoyl chloride is 87808-44-4.
What is the molecular formula of 3-Methoxy-4-methylbenzoyl chloride?
The molecular formula of 3-Methoxy-4-methylbenzoyl chloride is C9H9ClO2.
What is the molecular weight of 3-Methoxy-4-methylbenzoyl chloride?
The molecular weight of 3-Methoxy-4-methylbenzoyl chloride is 184.03 g/mol.
Where can I buy 3-Methoxy-4-methylbenzoyl chloride?
You can request a quote for 3-Methoxy-4-methylbenzoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methoxy-4-methylbenzoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Methoxy-4-methylbenzoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.