2-Hexanone, 5-(dimethylamino)-3,3-diphenyl-, hydrobromide
TL;DR: 2-Hexanone, 5-(dimethylamino)-3,3-diphenyl-, hydrobromide (CAS 67227-13-8) is a chemical compound with molecular formula C20H26BrNO and molecular weight 375.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-(5-oxo-4,4-diphenylhexan-2-yl)azanium bromide
Also Known As: 5-(Dimethylamino)-3,3-diphenyl-2-hexanone hydrobromide, 2-HEXANONE, 5-(DIMETHYLAMINO)-3,3-DIPHENYL-, HYDROBROMIDE, dimethyl-(5-oxo-4,4-diphenylhexan-2-yl)azanium bromide, RefChem:1063286
| Molecular Formula | C20H26BrNO |
|---|---|
| Molecular Weight | 375.12 g/mol |
| LogP | -0.51 |
| Topological Polar Surface Area | 21.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 375.11978 |
| Heavy Atoms | 23 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 67227-13-8 |
|---|---|
| SMILES | CC(CC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)C)[NH+](C)C.[Br-] |
| InChIKey | RODNYLOTNQZJSI-UHFFFAOYSA-N |
Product Overview
2-Hexanone, 5-(dimethylamino)-3,3-diphenyl-, hydrobromide (CAS 67227-13-8), with molecular formula C20H26BrNO and molecular weight 375.12 g/mol. IUPAC: dimethyl-(5-oxo-4,4-diphenylhexan-2-yl)azanium bromide.
Chemical Property Profile of 2-Hexanone, 5-(dimethylamino)-3,3-diphenyl-, hydrobromide
Property Insights of 2-Hexanone, 5-(dimethylamino)-3,3-diphenyl-, hydrobromide
The XLogP value of -0.51 indicates that 2-Hexanone, 5-(dimethylamino)-3,3-diphenyl-, hydrobromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 21.5 Ų, 2-Hexanone, 5-(dimethylamino)-3,3-diphenyl-, hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hexanone, 5-(dimethylamino)-3,3-diphenyl-, hydrobromide has 1 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 2-Hexanone, 5-(dimethylamino)-3,3-diphenyl-, hydrobromide?
The CAS number of 2-Hexanone, 5-(dimethylamino)-3,3-diphenyl-, hydrobromide is 67227-13-8.
What is the molecular formula of 2-Hexanone, 5-(dimethylamino)-3,3-diphenyl-, hydrobromide?
The molecular formula of 2-Hexanone, 5-(dimethylamino)-3,3-diphenyl-, hydrobromide is C20H26BrNO.
What is the molecular weight of 2-Hexanone, 5-(dimethylamino)-3,3-diphenyl-, hydrobromide?
The molecular weight of 2-Hexanone, 5-(dimethylamino)-3,3-diphenyl-, hydrobromide is 375.12 g/mol.
Where can I buy 2-Hexanone, 5-(dimethylamino)-3,3-diphenyl-, hydrobromide?
You can request a quote for 2-Hexanone, 5-(dimethylamino)-3,3-diphenyl-, hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hexanone, 5-(dimethylamino)-3,3-diphenyl-, hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for 2-Hexanone, 5-(dimethylamino)-3,3-diphenyl-, hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.