1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1)
TL;DR: 1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1) (CAS 64467-54-5) is a chemical compound with molecular formula C13H28ClN and molecular weight 233.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-propylheptan-4-yl)azetidin-1-ium chloride
Also Known As: 1-(1,1-Dipropylbutyl)azetidine hydrochloride, 1-(4-propylheptan-4-yl)azetidin-1-ium chloride, AZETIDINE, 1-(1,1-DIPROPYLBUTYL)-, HYDROCHLORIDE, 1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1), RefChem:1054472
| Molecular Formula | C13H28ClN |
|---|---|
| Molecular Weight | 233.19 g/mol |
| LogP | -0.58 |
| Topological Polar Surface Area | 4.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 7 |
| Exact Mass | 233.19102 |
| Heavy Atoms | 15 |
| Complexity | 132.0 |
Chemical Identifiers
| CAS Number | 64467-54-5 |
|---|---|
| SMILES | CCCC(CCC)(CCC)[NH+]1CCC1.[Cl-] |
| InChIKey | GOOPAVZKUXTISZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1) (CAS 64467-54-5), with molecular formula C13H28ClN and molecular weight 233.19 g/mol. IUPAC: 1-(4-propylheptan-4-yl)azetidin-1-ium chloride.
Chemical Property Profile of 1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1)
Property Insights of 1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1)
The XLogP value of -0.58 indicates that 1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 4.4 Ų, 1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1) has 1 hydrogen bond donor(s) and 1 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 1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1)?
The CAS number of 1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1) is 64467-54-5.
What is the molecular formula of 1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1)?
The molecular formula of 1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1) is C13H28ClN.
What is the molecular weight of 1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1)?
The molecular weight of 1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1) is 233.19 g/mol.
Where can I buy 1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1)?
You can request a quote for 1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Propylheptan-4-yl)azetidine--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.