Bromocresol Green
TL;DR: Bromocresol Green (CAS 76-60-8) is a chemical compound with molecular formula C21H14Br4O5S and molecular weight 693.72955 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,6-dibromo-4-[3-(3,5-dibromo-4-hydroxy-2-methylphenyl)-1,1-dioxo-2,1λ6-benzoxathiol-3-yl]-3-methylphenol
Also Known As: Bromocresol green, BROMCRESOL GREEN, Bromocresolgreen, bromo cresol green, Bromocresol blue
Application Areas
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C21H14Br4O5S |
| Molecular Weight | 693.72955 g/mol |
| XLogP | 6.5 |
| Topological Polar Surface Area (TPSA) | 92.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 697.72546 Da |
| Heavy Atoms | 31 |
| Complexity | 742.0 |
| Melting Point | 218.5 °C |
| SMILES | CC1=C(C(=C(C=C1C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C(=C4C)Br)O)Br)Br)O)Br |
| InChIKey | FRPHFZCDPYBUAU-UHFFFAOYSA-N |
Product Description
Applications: Bromocresol Green is used in pharmaceutical synthesis routes and API production, as well as analytical chemistry as a reagent, standard, or reference material. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A pharmaceutical intermediate supplied by CoreyChem, Bromocresol Green (CAS 76-60-8) has the molecular formula C21H14Br4O5S and a molecular weight of 693.73 g/mol. Synonyms include Bromocresol green and BROMCRESOL GREEN.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Bromocresol Green
Property Insights of Bromocresol Green
The XLogP value of 6.5 indicates that Bromocresol Green 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 Bromocresol Green. Following Lipinski's Rule of Five, Bromocresol Green has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Bromocresol Green?
The CAS number of Bromocresol Green is 76-60-8.
What is the molecular formula of Bromocresol Green?
The molecular formula of Bromocresol Green is C21H14Br4O5S.
What is the molecular weight of Bromocresol Green?
The molecular weight of Bromocresol Green is 693.72955 g/mol.
What are the applications of Bromocresol Green?
Bromocresol Green is used in pharmaceutical synthesis routes and API production, as well as analytical chemistry as a reagent, standard, or reference material. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Bromocresol Green?
You can request a quote for Bromocresol Green directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Bromocresol Green?
Yes, CoreyChem provides custom synthesis services for Bromocresol Green and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.