4-Bromo-m-cresol
TL;DR: 4-Bromo-m-cresol (CAS 14472-14-1) is a chemical compound with molecular formula C7H7BrO and molecular weight 185.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-3-methylphenol
Also Known As: 4-Bromo-3-methylphenol, 4-Bromo-m-cresol, 4-bromo-3-methyl-phenol, Phenol, 4-bromo-3-methyl-, 4-brom-3-methylphenol
| Molecular Formula | C7H7BrO |
|---|---|
| Molecular Weight | 185.97 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 185.96803 |
| Heavy Atoms | 9 |
| Complexity | 94.0 |
Chemical Identifiers
| CAS Number | 14472-14-1 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)O)Br |
| InChIKey | GPOQODYGMUTOQL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Bromo-m-cresol (CAS 14472-14-1), with molecular formula C7H7BrO and molecular weight 185.97 g/mol. IUPAC: 4-bromo-3-methylphenol.
Chemical Property Profile of 4-Bromo-m-cresol
Property Insights of 4-Bromo-m-cresol
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-m-cresol. With a topological polar surface area (TPSA) of 20.2 Ų, 4-Bromo-m-cresol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-m-cresol has 1 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 4-Bromo-m-cresol?
The CAS number of 4-Bromo-m-cresol is 14472-14-1.
What is the molecular formula of 4-Bromo-m-cresol?
The molecular formula of 4-Bromo-m-cresol is C7H7BrO.
What is the molecular weight of 4-Bromo-m-cresol?
The molecular weight of 4-Bromo-m-cresol is 185.97 g/mol.
Where can I buy 4-Bromo-m-cresol?
You can request a quote for 4-Bromo-m-cresol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-m-cresol?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-m-cresol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.