1-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene
TL;DR: 1-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene (CAS 2990109-99-2) is a chemical compound with molecular formula C11H12BrNO and molecular weight 253.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-bromophenyl)-pyrrolidin-1-ylmethanone
Also Known As: 1-(2-Bromobenzoyl)pyrrolidine, 1-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene, (2-bromophenyl)(pyrrolidin-1-yl)methanone, Methanone, (2-bromophenyl)-1-pyrrolidinyl-, (2-bromophenyl)-pyrrolidin-1-ylmethanone
| Molecular Formula | C11H12BrNO |
|---|---|
| Molecular Weight | 253.01 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 253.01022 |
| Heavy Atoms | 14 |
| Complexity | 213.0 |
Chemical Identifiers
| CAS Number | 2990109-99-2 |
|---|---|
| SMILES | C1CCN(C1)C(=O)C2=CC=CC=C2Br |
| InChIKey | MARIEGBUQWCPFS-UHFFFAOYSA-N |
Product Overview
1-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene (CAS 2990109-99-2), with molecular formula C11H12BrNO and molecular weight 253.01 g/mol. IUPAC: (2-bromophenyl)-pyrrolidin-1-ylmethanone.
Chemical Property Profile of 1-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene
Property Insights of 1-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene. With a topological polar surface area (TPSA) of 20.3 Ų, 1-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene has 0 hydrogen bond donor(s) and 1 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-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene?
The CAS number of 1-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene is 2990109-99-2.
What is the molecular formula of 1-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene?
The molecular formula of 1-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene is C11H12BrNO.
What is the molecular weight of 1-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene?
The molecular weight of 1-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene is 253.01 g/mol.
Where can I buy 1-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene?
You can request a quote for 1-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(Pyrrolidin-1-ylcarbonyl)-2-bromobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.