3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸
TL;DR: 3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸 (CAS 2509-46-8) is a chemical compound with molecular formula C18H18O3 and molecular weight 282.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸
3-methyl-2-(2,4,6-trimethylbenzoyl)benzoic acid
Also Known As: 3-methyl-2-(2,4,6-trimethylbenzoyl)benzoic acid, BENZOIC ACID,3-METHYL-2-(2,4,6-TRIMETHYLBENZOYL)-
| Molecular Formula | C18H18O3 |
|---|---|
| Molecular Weight | 282.13 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.12558 |
| Heavy Atoms | 21 |
| Complexity | 391.0 |
Chemical Identifiers
| CAS Number | 2509-46-8 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C(=O)O)C(=O)C2=C(C=C(C=C2C)C)C |
| InChIKey | CBCGTVOWIWEJQF-UHFFFAOYSA-N |
Product Overview
3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸 (CAS 2509-46-8), with molecular formula C18H18O3 and molecular weight 282.13 g/mol. IUPAC: 3-methyl-2-(2,4,6-trimethylbenzoyl)benzoic acid.
Chemical Property Profile of 3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸
Property Insights of 3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸
The XLogP value of 4.2 indicates that 3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸 has 1 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 3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸?
The CAS number of 3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸 is 2509-46-8.
What is the molecular formula of 3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸?
The molecular formula of 3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸 is C18H18O3.
What is the molecular weight of 3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸?
The molecular weight of 3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸 is 282.13 g/mol.
Where can I buy 3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸?
You can request a quote for 3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 3-甲基-2-(2,4,6-三甲基苯甲酰基)苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.