tert-Butyldiphenylphosphine oxide
TL;DR: tert-Butyldiphenylphosphine oxide (CAS 56598-35-7) is a chemical compound with molecular formula C16H19OP and molecular weight 258.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[tert-butyl(phenyl)phosphoryl]benzene
Also Known As: tert-Butyldiphenylphosphine oxide, (1,1-Dimethylethyl)diphenylphosphine oxide, D-Glucose-6,6-2H2, [tert-butyl(phenyl)phosphoryl]benzene, t-C4H9(C6H5)2PO
| Molecular Formula | C16H19OP |
|---|---|
| Molecular Weight | 258.12 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.11734 |
| Heavy Atoms | 18 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 56598-35-7 |
|---|---|
| SMILES | CC(C)(C)P(=O)(C1=CC=CC=C1)C2=CC=CC=C2 |
| InChIKey | CHFOAXGMRFQIOK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
tert-Butyldiphenylphosphine oxide (CAS 56598-35-7), with molecular formula C16H19OP and molecular weight 258.12 g/mol. IUPAC: [tert-butyl(phenyl)phosphoryl]benzene.
Chemical Property Profile of tert-Butyldiphenylphosphine oxide
Property Insights of tert-Butyldiphenylphosphine oxide
The XLogP value of 3.5 indicates that tert-Butyldiphenylphosphine oxide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, tert-Butyldiphenylphosphine oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-Butyldiphenylphosphine oxide 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 tert-Butyldiphenylphosphine oxide?
The CAS number of tert-Butyldiphenylphosphine oxide is 56598-35-7.
What is the molecular formula of tert-Butyldiphenylphosphine oxide?
The molecular formula of tert-Butyldiphenylphosphine oxide is C16H19OP.
What is the molecular weight of tert-Butyldiphenylphosphine oxide?
The molecular weight of tert-Butyldiphenylphosphine oxide is 258.12 g/mol.
Where can I buy tert-Butyldiphenylphosphine oxide?
You can request a quote for tert-Butyldiphenylphosphine oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-Butyldiphenylphosphine oxide?
Yes, KEHONG BIO provides custom synthesis services for tert-Butyldiphenylphosphine oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.