3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine
TL;DR: 3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine (CAS 94357-79-6) is a chemical compound with molecular formula C13H20BrNO2 and molecular weight 301.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1-propylpyrrolidin-3-yl)benzene-1,2-diol;hydrobromide
Also Known As: 3-Dppph, 3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine hydrobromide, 3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine, 4-(1-propylpyrrolidin-3-yl)benzene-1,2-diol hydrobromide, 1,2-Benzenediol, 4-(1-propyl-3-pyrrolidinyl)-, (S)-
| Molecular Formula | C13H20BrNO2 |
|---|---|
| Molecular Weight | 301.07 g/mol |
| LogP | 2.875 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.06775 |
| Heavy Atoms | 17 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 94357-79-6 |
|---|---|
| SMILES | CCCN1CCC(C1)C2=CC(=C(C=C2)O)O.Br |
| InChIKey | ASORCCUCEFNIRT-UHFFFAOYSA-N |
Product Overview
3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine (CAS 94357-79-6), with molecular formula C13H20BrNO2 and molecular weight 301.07 g/mol. IUPAC: 4-(1-propylpyrrolidin-3-yl)benzene-1,2-diol;hydrobromide.
Chemical Property Profile of 3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine
Property Insights of 3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine
The XLogP value of 2.875 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine. With a topological polar surface area (TPSA) of 43.7 Ų, 3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine 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 3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine?
The CAS number of 3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine is 94357-79-6.
What is the molecular formula of 3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine?
The molecular formula of 3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine is C13H20BrNO2.
What is the molecular weight of 3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine?
The molecular weight of 3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine is 301.07 g/mol.
Where can I buy 3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine?
You can request a quote for 3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 3-(3,4-Dihydroxyphenyl)-1-n-propylpyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.