N-(Propan-2-yl)hexan-1-amine
TL;DR: N-(Propan-2-yl)hexan-1-amine (CAS 78579-57-4) is a chemical compound with molecular formula C9H21N and molecular weight 143.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-propan-2-ylhexan-1-amine
Also Known As: isopropylhexylamine, isopropyl-n-hexyl-amine, hexyl(propan-2-yl)amine, N-Isopropyl-1-hexanamine, N-Isopropylhexane-1-amine
| Molecular Formula | C9H21N |
|---|---|
| Molecular Weight | 143.17 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 143.1674 |
| Heavy Atoms | 10 |
| Complexity | 59.0 |
Chemical Identifiers
| CAS Number | 78579-57-4 |
|---|---|
| SMILES | CCCCCCNC(C)C |
| InChIKey | LMJDMESPXVAQQY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(Propan-2-yl)hexan-1-amine (CAS 78579-57-4), with molecular formula C9H21N and molecular weight 143.17 g/mol. IUPAC: N-propan-2-ylhexan-1-amine.
Chemical Property Profile of N-(Propan-2-yl)hexan-1-amine
Property Insights of N-(Propan-2-yl)hexan-1-amine
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(Propan-2-yl)hexan-1-amine. With a topological polar surface area (TPSA) of 12.0 Ų, N-(Propan-2-yl)hexan-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(Propan-2-yl)hexan-1-amine 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 N-(Propan-2-yl)hexan-1-amine?
The CAS number of N-(Propan-2-yl)hexan-1-amine is 78579-57-4.
What is the molecular formula of N-(Propan-2-yl)hexan-1-amine?
The molecular formula of N-(Propan-2-yl)hexan-1-amine is C9H21N.
What is the molecular weight of N-(Propan-2-yl)hexan-1-amine?
The molecular weight of N-(Propan-2-yl)hexan-1-amine is 143.17 g/mol.
Where can I buy N-(Propan-2-yl)hexan-1-amine?
You can request a quote for N-(Propan-2-yl)hexan-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(Propan-2-yl)hexan-1-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(Propan-2-yl)hexan-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.