(2S)-1-(4-bromophenyl)-2-chloropropan-1-one
TL;DR: (2S)-1-(4-bromophenyl)-2-chloropropan-1-one (CAS 87010-95-5) is a chemical compound with molecular formula C9H8BrClO and molecular weight 245.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-1-(4-bromophenyl)-2-chloropropan-1-one
Also Known As: 1-(4-bromophenyl)-2-chloro-1-Propanone, 1-(4-bromophenyl)-2-chloropropan-1-one, (2S)-1-(4-bromophenyl)-2-chloropropan-1-one
| Molecular Formula | C9H8BrClO |
|---|---|
| Molecular Weight | 245.94 g/mol |
| LogP | 3.2591 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.94472 |
| Heavy Atoms | 12 |
| Complexity | 279.08493 |
Chemical Identifiers
| CAS Number | 87010-95-5 |
|---|---|
| SMILES | C[C@@H](C(=O)C1=CC=C(C=C1)Br)Cl |
Product Overview
(2S)-1-(4-bromophenyl)-2-chloropropan-1-one (CAS 87010-95-5), with molecular formula C9H8BrClO and molecular weight 245.94 g/mol. IUPAC: (2S)-1-(4-bromophenyl)-2-chloropropan-1-one.
Chemical Property Profile of (2S)-1-(4-bromophenyl)-2-chloropropan-1-one
Property Insights of (2S)-1-(4-bromophenyl)-2-chloropropan-1-one
The XLogP value of 3.2591 indicates that (2S)-1-(4-bromophenyl)-2-chloropropan-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, (2S)-1-(4-bromophenyl)-2-chloropropan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2S)-1-(4-bromophenyl)-2-chloropropan-1-one 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 (2S)-1-(4-bromophenyl)-2-chloropropan-1-one?
The CAS number of (2S)-1-(4-bromophenyl)-2-chloropropan-1-one is 87010-95-5.
What is the molecular formula of (2S)-1-(4-bromophenyl)-2-chloropropan-1-one?
The molecular formula of (2S)-1-(4-bromophenyl)-2-chloropropan-1-one is C9H8BrClO.
What is the molecular weight of (2S)-1-(4-bromophenyl)-2-chloropropan-1-one?
The molecular weight of (2S)-1-(4-bromophenyl)-2-chloropropan-1-one is 245.94 g/mol.
Where can I buy (2S)-1-(4-bromophenyl)-2-chloropropan-1-one?
You can request a quote for (2S)-1-(4-bromophenyl)-2-chloropropan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-1-(4-bromophenyl)-2-chloropropan-1-one?
Yes, KEHONG BIO provides custom synthesis services for (2S)-1-(4-bromophenyl)-2-chloropropan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.