Phenoxybenzamine
TL;DR: Phenoxybenzamine (CAS 59-96-1) is a chemical compound with molecular formula C18H22ClNO and molecular weight 303.13898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-benzyl-N-(2-chloroethyl)-1-phenoxypropan-2-amine
Also Known As: phenoxybenzamine, Dibenylin, Dibenzyline, Dibenyline, Bensylyt
Application Areas
Top 5 of 15 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H22ClNO |
| Molecular Weight | 303.13898 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 12.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 303.13898 Da |
| Heavy Atoms | 21 |
| Complexity | 262.0 |
| Melting Point | 39 |
| Solubility | WHITE CRYSTALLINE POWDER; SOL IN 9 PARTS CHLOROFORM; INSOL IN DIETHYLETHER /PHENOXYBENZAMINE HYDROCHLORIDE/ |
| SMILES | CC(COC1=CC=CC=C1)N(CCCl)CC2=CC=CC=C2 |
| InChIKey | QZVCTJOXCFMACW-UHFFFAOYSA-N |
Product Description
Applications: Phenoxybenzamine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A pharmaceutical intermediate supplied by CoreyChem, Phenoxybenzamine (CAS 59-96-1) has the molecular formula C18H22ClNO and a molecular weight of 303.14 g/mol. Reported properties include a solubility: WHITE CRYSTALLINE POWDER; SOL IN 9 PARTS CHLOROFORM; INSOL IN DIETHYLETHER /PHENOXYBENZAMINE HYDROCHLORIDE/. Synonyms include phenoxybenzamine and Dibenylin.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Phenoxybenzamine
Property Insights of Phenoxybenzamine
The XLogP value of 4.4 indicates that Phenoxybenzamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.5 Ų, Phenoxybenzamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenoxybenzamine has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Phenoxybenzamine?
The CAS number of Phenoxybenzamine is 59-96-1.
What is the molecular formula of Phenoxybenzamine?
The molecular formula of Phenoxybenzamine is C18H22ClNO.
What is the molecular weight of Phenoxybenzamine?
The molecular weight of Phenoxybenzamine is 303.13898 g/mol.
What are the applications of Phenoxybenzamine?
Phenoxybenzamine is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Phenoxybenzamine?
You can request a quote for Phenoxybenzamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phenoxybenzamine?
Yes, CoreyChem provides custom synthesis services for Phenoxybenzamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.