溴酚藍
TL;DR: 溴酚藍 (CAS 115-39-9) is a chemical compound with molecular formula C19H10Br4O5S and molecular weight 665.70 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
溴酚藍
2,6-dibromo-4-[3-(3,5-dibromo-4-hydroxyphenyl)-1,1-dioxo-2,1λ6-benzoxathiol-3-yl]phenol
Also Known As: Bromophenol blue, BROMPHENOL BLUE, Albutest, Tetrabromophenol blue, Tetrabromphenol Blue
| Molecular Formula | C19H10Br4O5S |
|---|---|
| Molecular Weight | 665.70 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 92.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 669.69415 |
| Heavy Atoms | 29 |
| Complexity | 662.0 |
| Melting Point | Decomposes at 279 °C (An orange discoloration with formation of a green sublimate sets in at 210 °C) |
| Solubility | Soluble in acetic acid |
Chemical Identifiers
| CAS Number | 115-39-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(OS2(=O)=O)(C3=CC(=C(C(=C3)Br)O)Br)C4=CC(=C(C(=C4)Br)O)Br |
| InChIKey | UDSAIICHUKSCKT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
溴酚藍 (CAS 115-39-9), with molecular formula C19H10Br4O5S and molecular weight 665.70 g/mol. IUPAC: 2,6-dibromo-4-[3-(3,5-dibromo-4-hydroxyphenyl)-1,1-dioxo-2,1λ6-benzoxathiol-3-yl]phenol.
Chemical Property Profile of 溴酚藍
Property Insights of 溴酚藍
The XLogP value of 5.8 indicates that 溴酚藍 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 溴酚藍. Following Lipinski's Rule of Five, 溴酚藍 has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 溴酚藍?
The CAS number of 溴酚藍 is 115-39-9.
What is the molecular formula of 溴酚藍?
The molecular formula of 溴酚藍 is C19H10Br4O5S.
What is the molecular weight of 溴酚藍?
The molecular weight of 溴酚藍 is 665.70 g/mol.
Where can I buy 溴酚藍?
You can request a quote for 溴酚藍 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 溴酚藍?
Yes, KEHONG BIO provides custom synthesis services for 溴酚藍 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.