C18H32ClN.ClH
TL;DR: C18H32ClN.ClH (CAS 31897-85-5) is a chemical compound with molecular formula C18H33Cl2N and molecular weight 333.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloro-3,5,7-trimethyl-1-adamantyl)-N,N-dimethylpropan-2-amine;hydrochloride
Also Known As: ADAMANTANE, 2-CHLORO-1-(2-DIMETHYLAMINOPROPYL)-3,5,7-TRIMETHYL-, HYDROCHLORIDE, 2-Propylamine, 1-(2-chloro-5,7-dimethyl-3-methyl-1-adamantyl)-N,N-dimethyl-, hydrochloride, 1-(2-Chloro-3,5,7-trimethyladamantan-1-yl)-N,N-dimethylpropan-2-amine--hydrogen chloride (1/1), 1-(2-chloro-3,5,7-trimethyl-1-adamantyl)-N,N-dimethylpropan-2-amine hydrochloride, 1-Adamantaneethylamine, 2-chloro-N,N,.alpha.,3,5,7-hexamethyl-, hydrochloride
| Molecular Formula | C18H33Cl2N |
|---|---|
| Molecular Weight | 333.20 g/mol |
| LogP | 5.35 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 333.199 |
| Heavy Atoms | 21 |
| Complexity | 398.0 |
Chemical Identifiers
| CAS Number | 31897-85-5 |
|---|---|
| SMILES | CC(CC12CC3(CC(C1)(CC(C3)(C2Cl)C)C)C)N(C)C.Cl |
| InChIKey | GGOYNTDJWDKZSC-UHFFFAOYSA-N |
Product Overview
C18H32ClN.ClH (CAS 31897-85-5), with molecular formula C18H33Cl2N and molecular weight 333.20 g/mol. IUPAC: 1-(2-chloro-3,5,7-trimethyl-1-adamantyl)-N,N-dimethylpropan-2-amine;hydrochloride.
Chemical Property Profile of C18H32ClN.ClH
Property Insights of C18H32ClN.ClH
The XLogP value of 5.35 indicates that C18H32ClN.ClH is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, C18H32ClN.ClH exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C18H32ClN.ClH has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C18H32ClN.ClH?
The CAS number of C18H32ClN.ClH is 31897-85-5.
What is the molecular formula of C18H32ClN.ClH?
The molecular formula of C18H32ClN.ClH is C18H33Cl2N.
What is the molecular weight of C18H32ClN.ClH?
The molecular weight of C18H32ClN.ClH is 333.20 g/mol.
Where can I buy C18H32ClN.ClH?
You can request a quote for C18H32ClN.ClH directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C18H32ClN.ClH?
Yes, KEHONG BIO provides custom synthesis services for C18H32ClN.ClH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.