2-Bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate
TL;DR: 2-Bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate (CAS 321969-01-1) is a chemical compound with molecular formula C16H13BrO4 and molecular weight 348.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-bromo-4-formyl-6-methoxyphenyl) 4-methylbenzoate
Also Known As: 2-bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate, starbld0028770, BAS 00346291, (2-bromo-4-formyl-6-methoxyphenyl) 4-methylbenzoate, AB01330812-02
| Molecular Formula | C16H13BrO4 |
|---|---|
| Molecular Weight | 348.00 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 347.99973 |
| Heavy Atoms | 21 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 321969-01-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2Br)C=O)OC |
| InChIKey | OCBXDTBOENCIOD-UHFFFAOYSA-N |
Product Overview
2-Bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate (CAS 321969-01-1), with molecular formula C16H13BrO4 and molecular weight 348.00 g/mol. IUPAC: (2-bromo-4-formyl-6-methoxyphenyl) 4-methylbenzoate.
Chemical Property Profile of 2-Bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate
Property Insights of 2-Bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate
The XLogP value of 3.8 indicates that 2-Bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, 2-Bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate has 0 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 2-Bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate?
The CAS number of 2-Bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate is 321969-01-1.
What is the molecular formula of 2-Bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate?
The molecular formula of 2-Bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate is C16H13BrO4.
What is the molecular weight of 2-Bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate?
The molecular weight of 2-Bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate is 348.00 g/mol.
Where can I buy 2-Bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate?
You can request a quote for 2-Bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-4-formyl-6-methoxyphenyl 4-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.