Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide
TL;DR: Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide (CAS 70044-79-0) is a chemical compound with molecular formula C16H20BrNO2 and molecular weight 337.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(2-phenylethylamino)ethyl]benzene-1,2-diol;hydrobromide
Also Known As: Dopamine, N-(2-phenethyl)-, hydrobromide, Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide, Phenethylamine, 3,4-dihydroxy-N-phenethyl-, hydrobromide, 1,2-Benzenediol, 4-(2-(phenethylamino)ethyl)-, hydrobromide, 4-[2-(phenethylamino)ethyl]benzene-1,2-diol hydrobromide
| Molecular Formula | C16H20BrNO2 |
|---|---|
| Molecular Weight | 337.07 g/mol |
| LogP | 3.0505 |
| Topological Polar Surface Area | 52.49 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 337.06775 |
| Heavy Atoms | 20 |
| Complexity | 517.14026 |
Chemical Identifiers
| CAS Number | 70044-79-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCNCCC2=CC(=C(C=C2)O)O.Br |
Product Overview
Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide (CAS 70044-79-0), with molecular formula C16H20BrNO2 and molecular weight 337.07 g/mol. IUPAC: 4-[2-(2-phenylethylamino)ethyl]benzene-1,2-diol;hydrobromide.
Chemical Property Profile of Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide
Property Insights of Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide
The XLogP value of 3.0505 indicates that Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.49 Ų, Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide has 3 hydrogen bond donor(s) and 3 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 Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide?
The CAS number of Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide is 70044-79-0.
What is the molecular formula of Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide?
The molecular formula of Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide is C16H20BrNO2.
What is the molecular weight of Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide?
The molecular weight of Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide is 337.07 g/mol.
Where can I buy Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide?
You can request a quote for Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for Pyrocatechol, 4-(2-(phenethylamino)ethyl)-, hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.