Benzylephedrine
TL;DR: Benzylephedrine (CAS 90-85-7) is a chemical compound with molecular formula C17H21NO and molecular weight 255.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[benzyl(methyl)amino]-1-phenylpropan-1-ol
Also Known As: Benzylephedrine, Benzylephedrin, N-Benzyl-ephedrin, N-benzylephedrine, EPHEDRINE, N-BENZYL-
| Molecular Formula | C17H21NO |
|---|---|
| Molecular Weight | 255.16 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 255.16231 |
| Heavy Atoms | 19 |
| Complexity | 244.0 |
Chemical Identifiers
| CAS Number | 90-85-7 |
|---|---|
| SMILES | CC(C(C1=CC=CC=C1)O)N(C)CC2=CC=CC=C2 |
| InChIKey | KLNGFIBGXXNTLD-UHFFFAOYSA-N |
Product Overview
Benzylephedrine (CAS 90-85-7), with molecular formula C17H21NO and molecular weight 255.16 g/mol. IUPAC: 2-[benzyl(methyl)amino]-1-phenylpropan-1-ol.
Chemical Property Profile of Benzylephedrine
Property Insights of Benzylephedrine
The XLogP value of 3.2 indicates that Benzylephedrine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 23.5 Ų, Benzylephedrine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzylephedrine has 1 hydrogen bond donor(s) and 2 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 Benzylephedrine?
The CAS number of Benzylephedrine is 90-85-7.
What is the molecular formula of Benzylephedrine?
The molecular formula of Benzylephedrine is C17H21NO.
What is the molecular weight of Benzylephedrine?
The molecular weight of Benzylephedrine is 255.16 g/mol.
Where can I buy Benzylephedrine?
You can request a quote for Benzylephedrine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzylephedrine?
Yes, KEHONG BIO provides custom synthesis services for Benzylephedrine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.