4-(Pyrrolidin-1-yl)phenacyl bromide
TL;DR: 4-(Pyrrolidin-1-yl)phenacyl bromide (CAS 216144-18-2) is a chemical compound with molecular formula C12H14BrNO and molecular weight 267.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-1-(4-pyrrolidin-1-ylphenyl)ethanone
Also Known As: 2-Bromo-1-(4-(pyrrolidin-1-yl)phenyl)ethanone, 2-bromo-1-(4-pyrrolidin-1-ylphenyl)ethanone, 4-(Pyrrolidin-1-yl)phenacyl bromide, ALPHA-BROMO-4-(1-PYRROLIDINO)ACETOPHENONE, Ethanone,2-bromo-1-[4-(1-pyrrolidinyl)phenyl]-
| Molecular Formula | C12H14BrNO |
|---|---|
| Molecular Weight | 267.03 g/mol |
| LogP | 2.8644 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.02588 |
| Heavy Atoms | 15 |
| Complexity | 341.14468 |
Chemical Identifiers
| CAS Number | 216144-18-2 |
|---|---|
| SMILES | C1CCN(C1)C2=CC=C(C=C2)C(=O)CBr |
Product Overview
4-(Pyrrolidin-1-yl)phenacyl bromide (CAS 216144-18-2), with molecular formula C12H14BrNO and molecular weight 267.03 g/mol. IUPAC: 2-bromo-1-(4-pyrrolidin-1-ylphenyl)ethanone.
Chemical Property Profile of 4-(Pyrrolidin-1-yl)phenacyl bromide
Property Insights of 4-(Pyrrolidin-1-yl)phenacyl bromide
The XLogP value of 2.8644 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(Pyrrolidin-1-yl)phenacyl bromide. With a topological polar surface area (TPSA) of 20.31 Ų, 4-(Pyrrolidin-1-yl)phenacyl bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Pyrrolidin-1-yl)phenacyl bromide has 0 hydrogen bond donor(s) and 2 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-(Pyrrolidin-1-yl)phenacyl bromide?
The CAS number of 4-(Pyrrolidin-1-yl)phenacyl bromide is 216144-18-2.
What is the molecular formula of 4-(Pyrrolidin-1-yl)phenacyl bromide?
The molecular formula of 4-(Pyrrolidin-1-yl)phenacyl bromide is C12H14BrNO.
What is the molecular weight of 4-(Pyrrolidin-1-yl)phenacyl bromide?
The molecular weight of 4-(Pyrrolidin-1-yl)phenacyl bromide is 267.03 g/mol.
Where can I buy 4-(Pyrrolidin-1-yl)phenacyl bromide?
You can request a quote for 4-(Pyrrolidin-1-yl)phenacyl bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Pyrrolidin-1-yl)phenacyl bromide?
Yes, KEHONG BIO provides custom synthesis services for 4-(Pyrrolidin-1-yl)phenacyl bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.