Buta-1,3-dien-1-yltriphenylphosphonium bromide
TL;DR: Buta-1,3-dien-1-yltriphenylphosphonium bromide (CAS 55795-18-1) is a chemical compound with molecular formula C22H20BrP and molecular weight 394.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1E)-buta-1,3-dienyl]-triphenylphosphanium bromide
Also Known As: TRIPHENYLPHOSPHONIUMBROMIDE, buta-1,3-dienylphosphanium,bromide, butadienyltriphenylphosphonium bromide, (E)-1-BUTADIENYLPHOSPHONIUM BROMIDE, Buta-1,3-dien-1-yltriphenylphosphonium bromide
| Molecular Formula | C22H20BrP |
|---|---|
| Molecular Weight | 394.05 g/mol |
| LogP | 1.6842 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 394.0486 |
| Heavy Atoms | 24 |
| Complexity | 683.30945 |
Chemical Identifiers
| CAS Number | 55795-18-1 |
|---|---|
| SMILES | C=C/C=C/[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-] |
Product Overview
Buta-1,3-dien-1-yltriphenylphosphonium bromide (CAS 55795-18-1), with molecular formula C22H20BrP and molecular weight 394.05 g/mol. IUPAC: [(1E)-buta-1,3-dienyl]-triphenylphosphanium bromide.
Chemical Property Profile of Buta-1,3-dien-1-yltriphenylphosphonium bromide
Property Insights of Buta-1,3-dien-1-yltriphenylphosphonium bromide
The XLogP value of 1.6842 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Buta-1,3-dien-1-yltriphenylphosphonium bromide. With a topological polar surface area (TPSA) of 0.0 Ų, Buta-1,3-dien-1-yltriphenylphosphonium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Buta-1,3-dien-1-yltriphenylphosphonium bromide has 0 hydrogen bond donor(s) and 0 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 Buta-1,3-dien-1-yltriphenylphosphonium bromide?
The CAS number of Buta-1,3-dien-1-yltriphenylphosphonium bromide is 55795-18-1.
What is the molecular formula of Buta-1,3-dien-1-yltriphenylphosphonium bromide?
The molecular formula of Buta-1,3-dien-1-yltriphenylphosphonium bromide is C22H20BrP.
What is the molecular weight of Buta-1,3-dien-1-yltriphenylphosphonium bromide?
The molecular weight of Buta-1,3-dien-1-yltriphenylphosphonium bromide is 394.05 g/mol.
Where can I buy Buta-1,3-dien-1-yltriphenylphosphonium bromide?
You can request a quote for Buta-1,3-dien-1-yltriphenylphosphonium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Buta-1,3-dien-1-yltriphenylphosphonium bromide?
Yes, KEHONG BIO provides custom synthesis services for Buta-1,3-dien-1-yltriphenylphosphonium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.