4-(2-Aminoethyl)pyrocatechol hydrobromide
TL;DR: 4-(2-Aminoethyl)pyrocatechol hydrobromide (CAS 645-31-8) is a chemical compound with molecular formula C8H12BrNO2 and molecular weight 233.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-aminoethyl)benzene-1,2-diol;hydrobromide
Also Known As: Dopamine hydrobromide, 3-Hydroxytyramine hydrobromide, dopamine, USAF EL-47, 3,4-Dihydroxy-phenethylamine hydrobromide
| Molecular Formula | C8H12BrNO2 |
|---|---|
| Molecular Weight | 233.01 g/mol |
| LogP | 1.18 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 233.00514 |
| Heavy Atoms | 12 |
| Complexity | 119.0 |
Chemical Identifiers
| CAS Number | 645-31-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1CCN)O)O.Br |
| InChIKey | SGRSNYSOAPBTJP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(2-Aminoethyl)pyrocatechol hydrobromide (CAS 645-31-8), with molecular formula C8H12BrNO2 and molecular weight 233.01 g/mol. IUPAC: 4-(2-aminoethyl)benzene-1,2-diol;hydrobromide.
Chemical Property Profile of 4-(2-Aminoethyl)pyrocatechol hydrobromide
Property Insights of 4-(2-Aminoethyl)pyrocatechol hydrobromide
The XLogP value of 1.18 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Aminoethyl)pyrocatechol hydrobromide. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Aminoethyl)pyrocatechol hydrobromide. Following Lipinski's Rule of Five, 4-(2-Aminoethyl)pyrocatechol hydrobromide has 4 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 4-(2-Aminoethyl)pyrocatechol hydrobromide?
The CAS number of 4-(2-Aminoethyl)pyrocatechol hydrobromide is 645-31-8.
What is the molecular formula of 4-(2-Aminoethyl)pyrocatechol hydrobromide?
The molecular formula of 4-(2-Aminoethyl)pyrocatechol hydrobromide is C8H12BrNO2.
What is the molecular weight of 4-(2-Aminoethyl)pyrocatechol hydrobromide?
The molecular weight of 4-(2-Aminoethyl)pyrocatechol hydrobromide is 233.01 g/mol.
Where can I buy 4-(2-Aminoethyl)pyrocatechol hydrobromide?
You can request a quote for 4-(2-Aminoethyl)pyrocatechol hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Aminoethyl)pyrocatechol hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Aminoethyl)pyrocatechol hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.