Boron monobromide monosulfide
TL;DR: Boron monobromide monosulfide (CAS 66904-99-2) is a chemical compound with molecular formula BBrS and molecular weight 121.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bromo(sulfanylidene)borane
Also Known As: bromothioborine, Boron monobromide monosulfide, Bromoboranethione, bromo(sulfanylidene)borane, Boronbromidesulfide
| Molecular Formula | BBrS |
|---|---|
| Molecular Weight | 121.90 g/mol |
| LogP | 1.113 |
| Topological Polar Surface Area | 32.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 121.89971 |
| Heavy Atoms | 3 |
| Complexity | 12.0 |
Chemical Identifiers
| CAS Number | 66904-99-2 |
|---|---|
| SMILES | B(=S)Br |
| InChIKey | XEUIIRCXJXTCOH-UHFFFAOYSA-N |
Product Overview
Boron monobromide monosulfide (CAS 66904-99-2), with molecular formula BBrS and molecular weight 121.90 g/mol. IUPAC: bromo(sulfanylidene)borane.
Chemical Property Profile of Boron monobromide monosulfide
Property Insights of Boron monobromide monosulfide
The XLogP value of 1.113 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boron monobromide monosulfide. With a topological polar surface area (TPSA) of 32.1 Ų, Boron monobromide monosulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Boron monobromide monosulfide has 0 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 Boron monobromide monosulfide?
The CAS number of Boron monobromide monosulfide is 66904-99-2.
What is the molecular formula of Boron monobromide monosulfide?
The molecular formula of Boron monobromide monosulfide is BBrS.
What is the molecular weight of Boron monobromide monosulfide?
The molecular weight of Boron monobromide monosulfide is 121.90 g/mol.
Where can I buy Boron monobromide monosulfide?
You can request a quote for Boron monobromide monosulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Boron monobromide monosulfide?
Yes, KEHONG BIO provides custom synthesis services for Boron monobromide monosulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.