Cyclohexanone, dihydrochloride
TL;DR: Cyclohexanone, dihydrochloride (CAS 6344-77-0) is a chemical compound with molecular formula C15H29ClN2O and molecular weight 288.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(dimethylamino)methyl]-6-(piperidin-1-ylmethyl)cyclohexan-1-one;hydrochloride
Also Known As: Cyclohexanone, diHCl, Cyclohexanone, dihydrochloride, 2-((Dimethylamino)methyl)-6-(1-piperidinylmethyl)cyclohexanone, Cyclohexanone, 2-[(dimethylamino)methyl]-6-(1-piperidinylmethyl)-, monohydrochloride, 2-(dimethylaminomethyl)-6-(piperidin-1-ylmethyl)cyclohexan-1-one hydrochloride
| Molecular Formula | C15H29ClN2O |
|---|---|
| Molecular Weight | 288.20 g/mol |
| LogP | 2.4411 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 288.19684 |
| Heavy Atoms | 19 |
| Complexity | 272.0 |
Chemical Identifiers
| CAS Number | 6344-77-0 |
|---|---|
| SMILES | CN(C)CC1CCCC(C1=O)CN2CCCCC2.Cl |
| InChIKey | JQZWLKOQZGPSAC-UHFFFAOYSA-N |
Product Overview
Cyclohexanone, dihydrochloride (CAS 6344-77-0), with molecular formula C15H29ClN2O and molecular weight 288.20 g/mol. IUPAC: 2-[(dimethylamino)methyl]-6-(piperidin-1-ylmethyl)cyclohexan-1-one;hydrochloride.
Chemical Property Profile of Cyclohexanone, dihydrochloride
Property Insights of Cyclohexanone, dihydrochloride
The XLogP value of 2.4411 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclohexanone, dihydrochloride. With a topological polar surface area (TPSA) of 23.6 Ų, Cyclohexanone, dihydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexanone, dihydrochloride 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 Cyclohexanone, dihydrochloride?
The CAS number of Cyclohexanone, dihydrochloride is 6344-77-0.
What is the molecular formula of Cyclohexanone, dihydrochloride?
The molecular formula of Cyclohexanone, dihydrochloride is C15H29ClN2O.
What is the molecular weight of Cyclohexanone, dihydrochloride?
The molecular weight of Cyclohexanone, dihydrochloride is 288.20 g/mol.
Where can I buy Cyclohexanone, dihydrochloride?
You can request a quote for Cyclohexanone, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexanone, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexanone, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.