3-Heptanone, 7-dimethylamino-4,4-diphenyl-, hydrochloride
TL;DR: 3-Heptanone, 7-dimethylamino-4,4-diphenyl-, hydrochloride (CAS 63834-34-4) is a chemical compound with molecular formula C21H28ClNO and molecular weight 345.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl-(5-oxo-4,4-diphenylheptyl)azanium chloride
Also Known As: 7-Dimethylamino-4,4-diphenyl-3-heptanone hydrochloride, 3-HEPTANONE, 7-DIMETHYLAMINO-4,4-DIPHENYL-, HYDROCHLORIDE, dimethyl-(5-oxo-4,4-diphenylheptyl)azanium chloride, 3-Heptanone, 7-(dimethylamino)-4,4-diphenyl-, hydrochloride, RefChem:279637
| Molecular Formula | C21H28ClNO |
|---|---|
| Molecular Weight | 345.19 g/mol |
| LogP | -0.12 |
| Topological Polar Surface Area | 21.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 345.18594 |
| Heavy Atoms | 24 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 63834-34-4 |
|---|---|
| SMILES | CCC(=O)C(CCC[NH+](C)C)(C1=CC=CC=C1)C2=CC=CC=C2.[Cl-] |
| InChIKey | ACIZPTCLQKKZKN-UHFFFAOYSA-N |
Product Overview
3-Heptanone, 7-dimethylamino-4,4-diphenyl-, hydrochloride (CAS 63834-34-4), with molecular formula C21H28ClNO and molecular weight 345.19 g/mol. IUPAC: dimethyl-(5-oxo-4,4-diphenylheptyl)azanium chloride.
Chemical Property Profile of 3-Heptanone, 7-dimethylamino-4,4-diphenyl-, hydrochloride
Property Insights of 3-Heptanone, 7-dimethylamino-4,4-diphenyl-, hydrochloride
The XLogP value of -0.12 indicates that 3-Heptanone, 7-dimethylamino-4,4-diphenyl-, hydrochloride 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, 3-Heptanone, 7-dimethylamino-4,4-diphenyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Heptanone, 7-dimethylamino-4,4-diphenyl-, hydrochloride 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 3-Heptanone, 7-dimethylamino-4,4-diphenyl-, hydrochloride?
The CAS number of 3-Heptanone, 7-dimethylamino-4,4-diphenyl-, hydrochloride is 63834-34-4.
What is the molecular formula of 3-Heptanone, 7-dimethylamino-4,4-diphenyl-, hydrochloride?
The molecular formula of 3-Heptanone, 7-dimethylamino-4,4-diphenyl-, hydrochloride is C21H28ClNO.
What is the molecular weight of 3-Heptanone, 7-dimethylamino-4,4-diphenyl-, hydrochloride?
The molecular weight of 3-Heptanone, 7-dimethylamino-4,4-diphenyl-, hydrochloride is 345.19 g/mol.
Where can I buy 3-Heptanone, 7-dimethylamino-4,4-diphenyl-, hydrochloride?
You can request a quote for 3-Heptanone, 7-dimethylamino-4,4-diphenyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Heptanone, 7-dimethylamino-4,4-diphenyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Heptanone, 7-dimethylamino-4,4-diphenyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.