4,4-Dimethyl-1,1-diphenylpentan-3-one
TL;DR: 4,4-Dimethyl-1,1-diphenylpentan-3-one (CAS 58177-49-4) is a chemical compound with molecular formula C19H22O and molecular weight 266.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,4-dimethyl-1,1-diphenylpentan-3-one
Also Known As: 4,4-dimethyl-1,1-diphenylpentan-3-one, 4,1-DIPHENYL-3-PENTANONE, 5,5-Dimethyl-1,1-diphenyl-3-hexanon, 1,1-Diphenyl-4,4-dimethyl-3-pentanone, J3.637.889A
| Molecular Formula | C19H22O |
|---|---|
| Molecular Weight | 266.17 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 266.16705 |
| Heavy Atoms | 20 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 58177-49-4 |
|---|---|
| SMILES | CC(C)(C)C(=O)CC(C1=CC=CC=C1)C2=CC=CC=C2 |
| InChIKey | XBGGFYAMBLXNTI-UHFFFAOYSA-N |
Product Overview
4,4-Dimethyl-1,1-diphenylpentan-3-one (CAS 58177-49-4), with molecular formula C19H22O and molecular weight 266.17 g/mol. IUPAC: 4,4-dimethyl-1,1-diphenylpentan-3-one.
Chemical Property Profile of 4,4-Dimethyl-1,1-diphenylpentan-3-one
Property Insights of 4,4-Dimethyl-1,1-diphenylpentan-3-one
The XLogP value of 4.7 indicates that 4,4-Dimethyl-1,1-diphenylpentan-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 4,4-Dimethyl-1,1-diphenylpentan-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,4-Dimethyl-1,1-diphenylpentan-3-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 4,4-Dimethyl-1,1-diphenylpentan-3-one?
The CAS number of 4,4-Dimethyl-1,1-diphenylpentan-3-one is 58177-49-4.
What is the molecular formula of 4,4-Dimethyl-1,1-diphenylpentan-3-one?
The molecular formula of 4,4-Dimethyl-1,1-diphenylpentan-3-one is C19H22O.
What is the molecular weight of 4,4-Dimethyl-1,1-diphenylpentan-3-one?
The molecular weight of 4,4-Dimethyl-1,1-diphenylpentan-3-one is 266.17 g/mol.
Where can I buy 4,4-Dimethyl-1,1-diphenylpentan-3-one?
You can request a quote for 4,4-Dimethyl-1,1-diphenylpentan-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,4-Dimethyl-1,1-diphenylpentan-3-one?
Yes, KEHONG BIO provides custom synthesis services for 4,4-Dimethyl-1,1-diphenylpentan-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.