1-Benzyl-3,4-dimethyl-1h-phosphole
TL;DR: 1-Benzyl-3,4-dimethyl-1h-phosphole (CAS 39099-23-5) is a chemical compound with molecular formula C13H15P and molecular weight 202.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3,4-dimethylphosphole
Also Known As: 1-benzyl-3,4-dimethyl-1h-phosphole, 1-benzyl-3,4-dimethylphosphole, J2.029.203B, InChI=1/C13H15P/c1-11-8-14(9-12(11)2)10-13-6-4-3-5-7-13/h3-9H,10H2,1-2H
| Molecular Formula | C13H15P |
|---|---|
| Molecular Weight | 202.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.09114 |
| Heavy Atoms | 14 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 39099-23-5 |
|---|---|
| SMILES | CC1=CP(C=C1C)CC2=CC=CC=C2 |
| InChIKey | AXGXNZWFWIOSND-UHFFFAOYSA-N |
Product Overview
1-Benzyl-3,4-dimethyl-1h-phosphole (CAS 39099-23-5), with molecular formula C13H15P and molecular weight 202.09 g/mol. IUPAC: 1-benzyl-3,4-dimethylphosphole.
Chemical Property Profile of 1-Benzyl-3,4-dimethyl-1h-phosphole
Property Insights of 1-Benzyl-3,4-dimethyl-1h-phosphole
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Benzyl-3,4-dimethyl-1h-phosphole. With a topological polar surface area (TPSA) of 0.0 Ų, 1-Benzyl-3,4-dimethyl-1h-phosphole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-3,4-dimethyl-1h-phosphole 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 1-Benzyl-3,4-dimethyl-1h-phosphole?
The CAS number of 1-Benzyl-3,4-dimethyl-1h-phosphole is 39099-23-5.
What is the molecular formula of 1-Benzyl-3,4-dimethyl-1h-phosphole?
The molecular formula of 1-Benzyl-3,4-dimethyl-1h-phosphole is C13H15P.
What is the molecular weight of 1-Benzyl-3,4-dimethyl-1h-phosphole?
The molecular weight of 1-Benzyl-3,4-dimethyl-1h-phosphole is 202.09 g/mol.
Where can I buy 1-Benzyl-3,4-dimethyl-1h-phosphole?
You can request a quote for 1-Benzyl-3,4-dimethyl-1h-phosphole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-3,4-dimethyl-1h-phosphole?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-3,4-dimethyl-1h-phosphole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.