3-Hexanol, 6-(dimethylamino)methyl-4,4-diphenyl-, acetate, hydrochloride
TL;DR: 3-Hexanol, 6-(dimethylamino)methyl-4,4-diphenyl-, acetate, hydrochloride (CAS 63765-82-2) is a chemical compound with molecular formula C23H32ClNO2 and molecular weight 389.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-acetyloxy-4,4-diphenylheptyl)-dimethylazanium chloride
Also Known As: 5-Acetoxy-N,N-dimethyl-4,4-diphenylheptylamine hydrochloride, (5-acetyloxy-4,4-diphenylheptyl)-dimethylazanium chloride, 3-HEXANOL, 6-(DIMETHYLAMINO)METHYL-4,4-DIPHENYL-, ACETATE, HYDROCHLORIDE, Heptylamine, 5-acetoxy-N,N-dimethyl-4,4-diphenyl-, hydrochloride, 3-Acetoxy-6-dimethylamino-4,4-diphenyl-5-methyl hexane hydrochloride
| Molecular Formula | C23H32ClNO2 |
|---|---|
| Molecular Weight | 389.21 g/mol |
| LogP | 0.24 |
| Topological Polar Surface Area | 30.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 389.21216 |
| Heavy Atoms | 27 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 63765-82-2 |
|---|---|
| SMILES | CCC(C(CCC[NH+](C)C)(C1=CC=CC=C1)C2=CC=CC=C2)OC(=O)C.[Cl-] |
| InChIKey | PBHIEANRWCQSNC-UHFFFAOYSA-N |
Product Overview
3-Hexanol, 6-(dimethylamino)methyl-4,4-diphenyl-, acetate, hydrochloride (CAS 63765-82-2), with molecular formula C23H32ClNO2 and molecular weight 389.21 g/mol. IUPAC: (5-acetyloxy-4,4-diphenylheptyl)-dimethylazanium chloride.
Chemical Property Profile of 3-Hexanol, 6-(dimethylamino)methyl-4,4-diphenyl-, acetate, hydrochloride
Property Insights of 3-Hexanol, 6-(dimethylamino)methyl-4,4-diphenyl-, acetate, hydrochloride
The XLogP value of 0.24 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hexanol, 6-(dimethylamino)methyl-4,4-diphenyl-, acetate, hydrochloride. With a topological polar surface area (TPSA) of 30.7 Ų, 3-Hexanol, 6-(dimethylamino)methyl-4,4-diphenyl-, acetate, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hexanol, 6-(dimethylamino)methyl-4,4-diphenyl-, acetate, hydrochloride has 1 hydrogen bond donor(s) and 3 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-Hexanol, 6-(dimethylamino)methyl-4,4-diphenyl-, acetate, hydrochloride?
The CAS number of 3-Hexanol, 6-(dimethylamino)methyl-4,4-diphenyl-, acetate, hydrochloride is 63765-82-2.
What is the molecular formula of 3-Hexanol, 6-(dimethylamino)methyl-4,4-diphenyl-, acetate, hydrochloride?
The molecular formula of 3-Hexanol, 6-(dimethylamino)methyl-4,4-diphenyl-, acetate, hydrochloride is C23H32ClNO2.
What is the molecular weight of 3-Hexanol, 6-(dimethylamino)methyl-4,4-diphenyl-, acetate, hydrochloride?
The molecular weight of 3-Hexanol, 6-(dimethylamino)methyl-4,4-diphenyl-, acetate, hydrochloride is 389.21 g/mol.
Where can I buy 3-Hexanol, 6-(dimethylamino)methyl-4,4-diphenyl-, acetate, hydrochloride?
You can request a quote for 3-Hexanol, 6-(dimethylamino)methyl-4,4-diphenyl-, acetate, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hexanol, 6-(dimethylamino)methyl-4,4-diphenyl-, acetate, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Hexanol, 6-(dimethylamino)methyl-4,4-diphenyl-, acetate, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.