Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester
TL;DR: Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester (CAS 34874-81-2) is a chemical compound with molecular formula C18H20O4 and molecular weight 300.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-hydroxy-3,5,6-trimethyl-4-phenylmethoxybenzoate
Also Known As: Methyl 4-(benzyloxy)-2-hydroxy-3,5,6-trimethylbenzoate, 4-2-hydroxy-3,5,6-trimethylbenzoicacidmethylester, 4- -2-hydroxy-3,5,6-trimethylbenzoicacidmethylester, methyl 2-hydroxy-3,5,6-trimethyl-4-phenylmethoxybenzoate, Methyl 4-(benzyloxy)-2-hydroxy-3,5,6-trimethylbenzoate #
| Molecular Formula | C18H20O4 |
|---|---|
| Molecular Weight | 300.14 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 300.13617 |
| Heavy Atoms | 22 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 34874-81-2 |
|---|---|
| SMILES | CC1=C(C(=C(C(=C1C(=O)OC)O)C)OCC2=CC=CC=C2)C |
| InChIKey | FZAKPFZCEORQLU-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester (CAS 34874-81-2), with molecular formula C18H20O4 and molecular weight 300.14 g/mol. IUPAC: methyl 2-hydroxy-3,5,6-trimethyl-4-phenylmethoxybenzoate.
Chemical Property Profile of Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester
Property Insights of Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester
The XLogP value of 4.5 indicates that Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.8 Ų, Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester has 1 hydrogen bond donor(s) and 4 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 Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester?
The CAS number of Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester is 34874-81-2.
What is the molecular formula of Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester?
The molecular formula of Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester is C18H20O4.
What is the molecular weight of Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester?
The molecular weight of Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester is 300.14 g/mol.
Where can I buy Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester?
You can request a quote for Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-hydroxy-3,5,6-trimethyl-4-(phenylmethoxy)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.