1-(Triphenylphosphoranylidene)acetone
TL;DR: 1-(Triphenylphosphoranylidene)acetone (CAS 1439-36-7) is a chemical compound with molecular formula C21H19OP and molecular weight 318.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(triphenyl-λ5-phosphanylidene)propan-2-one
Also Known As: (Acetylmethylene)triphenylphosphorane, 1-(Triphenylphosphoranylidene)propan-2-one, 1-(Triphenylphosphoranylidene)-2-propanone, 1-(triphenyl-, 1-(Triphenylphosphoranylidene)acetone
| Molecular Formula | C21H19OP |
|---|---|
| Molecular Weight | 318.12 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 318.11734 |
| Heavy Atoms | 23 |
| Complexity | 382.0 |
Chemical Identifiers
| CAS Number | 1439-36-7 |
|---|---|
| SMILES | CC(=O)C=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | KAANTNXREIRLCT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(Triphenylphosphoranylidene)acetone (CAS 1439-36-7), with molecular formula C21H19OP and molecular weight 318.12 g/mol. IUPAC: 1-(triphenyl-λ5-phosphanylidene)propan-2-one.
Chemical Property Profile of 1-(Triphenylphosphoranylidene)acetone
Property Insights of 1-(Triphenylphosphoranylidene)acetone
The XLogP value of 3.6 indicates that 1-(Triphenylphosphoranylidene)acetone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 1-(Triphenylphosphoranylidene)acetone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Triphenylphosphoranylidene)acetone 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 1-(Triphenylphosphoranylidene)acetone?
The CAS number of 1-(Triphenylphosphoranylidene)acetone is 1439-36-7.
What is the molecular formula of 1-(Triphenylphosphoranylidene)acetone?
The molecular formula of 1-(Triphenylphosphoranylidene)acetone is C21H19OP.
What is the molecular weight of 1-(Triphenylphosphoranylidene)acetone?
The molecular weight of 1-(Triphenylphosphoranylidene)acetone is 318.12 g/mol.
Where can I buy 1-(Triphenylphosphoranylidene)acetone?
You can request a quote for 1-(Triphenylphosphoranylidene)acetone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Triphenylphosphoranylidene)acetone?
Yes, KEHONG BIO provides custom synthesis services for 1-(Triphenylphosphoranylidene)acetone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.