4-Chloro-3,4-diphenylbutan-2-one
TL;DR: 4-Chloro-3,4-diphenylbutan-2-one (CAS 327077-79-2) is a chemical compound with molecular formula C16H15ClO and molecular weight 258.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-3,4-diphenylbutan-2-one
Also Known As: 4-chloro-3,4-diphenylbutan-2-one, 4-Chloro-3,4-diphenyl-butan-2-one
| Molecular Formula | C16H15ClO |
|---|---|
| Molecular Weight | 258.08 g/mol |
| LogP | 4.3393 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 258.08115 |
| Heavy Atoms | 18 |
| Complexity | 507.1349 |
Chemical Identifiers
| CAS Number | 327077-79-2 |
|---|---|
| SMILES | CC(=O)C(C1=CC=CC=C1)C(C2=CC=CC=C2)Cl |
Product Overview
4-Chloro-3,4-diphenylbutan-2-one (CAS 327077-79-2), with molecular formula C16H15ClO and molecular weight 258.08 g/mol. IUPAC: 4-chloro-3,4-diphenylbutan-2-one.
Chemical Property Profile of 4-Chloro-3,4-diphenylbutan-2-one
Property Insights of 4-Chloro-3,4-diphenylbutan-2-one
The XLogP value of 4.3393 indicates that 4-Chloro-3,4-diphenylbutan-2-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, 4-Chloro-3,4-diphenylbutan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-3,4-diphenylbutan-2-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 4-Chloro-3,4-diphenylbutan-2-one?
The CAS number of 4-Chloro-3,4-diphenylbutan-2-one is 327077-79-2.
What is the molecular formula of 4-Chloro-3,4-diphenylbutan-2-one?
The molecular formula of 4-Chloro-3,4-diphenylbutan-2-one is C16H15ClO.
What is the molecular weight of 4-Chloro-3,4-diphenylbutan-2-one?
The molecular weight of 4-Chloro-3,4-diphenylbutan-2-one is 258.08 g/mol.
Where can I buy 4-Chloro-3,4-diphenylbutan-2-one?
You can request a quote for 4-Chloro-3,4-diphenylbutan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-3,4-diphenylbutan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-3,4-diphenylbutan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.