2,3,4,5,6-Pentamethylbenzoyl chloride
TL;DR: 2,3,4,5,6-Pentamethylbenzoyl chloride (CAS 160723-85-3) is a chemical compound with molecular formula C12H15ClO and molecular weight 210.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3,4,5,6-pentamethylbenzoyl chloride
Also Known As: 2,3,4,5,6-pentamethylbenzoyl chloride, Benzoylchloride,2,3,4,5,6-pentamethyl-, 2,3,4,5,6-pentamethyl-benzoyl chloride
| Molecular Formula | C12H15ClO |
|---|---|
| Molecular Weight | 210.08 g/mol |
| LogP | 3.6077 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 210.08115 |
| Heavy Atoms | 14 |
| Complexity | 376.26813 |
Chemical Identifiers
| CAS Number | 160723-85-3 |
|---|---|
| SMILES | CC1=C(C(=C(C(=C1C)C)C(=O)Cl)C)C |
Product Overview
2,3,4,5,6-Pentamethylbenzoyl chloride (CAS 160723-85-3), with molecular formula C12H15ClO and molecular weight 210.08 g/mol. IUPAC: 2,3,4,5,6-pentamethylbenzoyl chloride.
Chemical Property Profile of 2,3,4,5,6-Pentamethylbenzoyl chloride
Property Insights of 2,3,4,5,6-Pentamethylbenzoyl chloride
The XLogP value of 3.6077 indicates that 2,3,4,5,6-Pentamethylbenzoyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 2,3,4,5,6-Pentamethylbenzoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4,5,6-Pentamethylbenzoyl chloride 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 2,3,4,5,6-Pentamethylbenzoyl chloride?
The CAS number of 2,3,4,5,6-Pentamethylbenzoyl chloride is 160723-85-3.
What is the molecular formula of 2,3,4,5,6-Pentamethylbenzoyl chloride?
The molecular formula of 2,3,4,5,6-Pentamethylbenzoyl chloride is C12H15ClO.
What is the molecular weight of 2,3,4,5,6-Pentamethylbenzoyl chloride?
The molecular weight of 2,3,4,5,6-Pentamethylbenzoyl chloride is 210.08 g/mol.
Where can I buy 2,3,4,5,6-Pentamethylbenzoyl chloride?
You can request a quote for 2,3,4,5,6-Pentamethylbenzoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4,5,6-Pentamethylbenzoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4,5,6-Pentamethylbenzoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.