![1,3-Propanediamine, N-[3-(isodecyloxy)propyl]- structure](/static/products/7716/77164-89-7.webp)
1,3-Propanediamine, N-[3-(isodecyloxy)propyl]-
TL;DR: 1,3-Propanediamine, N-[3-(isodecyloxy)propyl]- (CAS 77164-89-7) is a chemical compound with molecular formula C16H36N2O and molecular weight 272.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[3-(8-methylnonoxy)propyl]propane-1,3-diamine
Also Known As: 1,3-Propanediamine, N-[3-(isodecyloxy)propyl]-, 3-(3-Isodecyloxypropylamino)propylamine, N'-[3-(8-methylnonoxy)propyl]propane-1,3-diamine, N-[3- propyl]propane-1,3-diamine, 1,3-Propanediamine,N-[3-(isodecyloxy)propyl]-
| Molecular Formula | C16H36N2O |
|---|---|
| Molecular Weight | 272.28 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 47.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 15 |
| Exact Mass | 272.28278 |
| Heavy Atoms | 19 |
| Complexity | 163.0 |
Chemical Identifiers
| CAS Number | 77164-89-7 |
|---|---|
| SMILES | CC(C)CCCCCCCOCCCNCCCN |
| InChIKey | LMVFSACRPDMFSQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Propanediamine, N-[3-(isodecyloxy)propyl]- (CAS 77164-89-7), with molecular formula C16H36N2O and molecular weight 272.28 g/mol. IUPAC: N'-[3-(8-methylnonoxy)propyl]propane-1,3-diamine.
Chemical Property Profile of 1,3-Propanediamine, N-[3-(isodecyloxy)propyl]-
Property Insights of 1,3-Propanediamine, N-[3-(isodecyloxy)propyl]-
The XLogP value of 3.6 indicates that 1,3-Propanediamine, N-[3-(isodecyloxy)propyl]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.3 Ų, 1,3-Propanediamine, N-[3-(isodecyloxy)propyl]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Propanediamine, N-[3-(isodecyloxy)propyl]- has 2 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 1,3-Propanediamine, N-[3-(isodecyloxy)propyl]-?
The CAS number of 1,3-Propanediamine, N-[3-(isodecyloxy)propyl]- is 77164-89-7.
What is the molecular formula of 1,3-Propanediamine, N-[3-(isodecyloxy)propyl]-?
The molecular formula of 1,3-Propanediamine, N-[3-(isodecyloxy)propyl]- is C16H36N2O.
What is the molecular weight of 1,3-Propanediamine, N-[3-(isodecyloxy)propyl]-?
The molecular weight of 1,3-Propanediamine, N-[3-(isodecyloxy)propyl]- is 272.28 g/mol.
Where can I buy 1,3-Propanediamine, N-[3-(isodecyloxy)propyl]-?
You can request a quote for 1,3-Propanediamine, N-[3-(isodecyloxy)propyl]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Propanediamine, N-[3-(isodecyloxy)propyl]-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Propanediamine, N-[3-(isodecyloxy)propyl]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.