1-(4-bromo-2-nitrophenyl)pyrrolidine
TL;DR: 1-(4-bromo-2-nitrophenyl)pyrrolidine (CAS 59963-00-7) is a chemical compound with molecular formula C10H11BrN2O2 and molecular weight 270.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-bromo-2-nitrophenyl)pyrrolidine
Also Known As: 1-(4-bromo-2-nitrophenyl)pyrrolidine, 5-bromo-2-(pyrrolidin-1-yl)nitrobenzene, Pyrrolidine, 1-(4-bromo-2-nitrophenyl)-, 1-(4-bromo-2-nitro-phenyl)pyrrolidine, 1-(4-BROMO-2-NITROPHENYL)-PYRROLIDINE
| Molecular Formula | C10H11BrN2O2 |
|---|---|
| Molecular Weight | 270.00 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 49.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 270.0004 |
| Heavy Atoms | 15 |
| Complexity | 238.0 |
Chemical Identifiers
| CAS Number | 59963-00-7 |
|---|---|
| SMILES | C1CCN(C1)C2=C(C=C(C=C2)Br)[N+](=O)[O-] |
| InChIKey | RTJSJJAEUUKHDP-UHFFFAOYSA-N |
Product Overview
1-(4-bromo-2-nitrophenyl)pyrrolidine (CAS 59963-00-7), with molecular formula C10H11BrN2O2 and molecular weight 270.00 g/mol. IUPAC: 1-(4-bromo-2-nitrophenyl)pyrrolidine.
Chemical Property Profile of 1-(4-bromo-2-nitrophenyl)pyrrolidine
Property Insights of 1-(4-bromo-2-nitrophenyl)pyrrolidine
The XLogP value of 3.1 indicates that 1-(4-bromo-2-nitrophenyl)pyrrolidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.1 Ų, 1-(4-bromo-2-nitrophenyl)pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-bromo-2-nitrophenyl)pyrrolidine has 0 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 1-(4-bromo-2-nitrophenyl)pyrrolidine?
The CAS number of 1-(4-bromo-2-nitrophenyl)pyrrolidine is 59963-00-7.
What is the molecular formula of 1-(4-bromo-2-nitrophenyl)pyrrolidine?
The molecular formula of 1-(4-bromo-2-nitrophenyl)pyrrolidine is C10H11BrN2O2.
What is the molecular weight of 1-(4-bromo-2-nitrophenyl)pyrrolidine?
The molecular weight of 1-(4-bromo-2-nitrophenyl)pyrrolidine is 270.00 g/mol.
Where can I buy 1-(4-bromo-2-nitrophenyl)pyrrolidine?
You can request a quote for 1-(4-bromo-2-nitrophenyl)pyrrolidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-bromo-2-nitrophenyl)pyrrolidine?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-bromo-2-nitrophenyl)pyrrolidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.