对异丙基-N-辛基苄胺
TL;DR: 对异丙基-N-辛基苄胺 (CAS 63991-64-0) is a chemical compound with molecular formula C18H31N and molecular weight 261.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
对异丙基-N-辛基苄胺
N-[(4-propan-2-ylphenyl)methyl]octan-1-amine
Also Known As: p-Isopropylbenzyloctylamine, Octylamine, N-(p-isopropylbenzyl)-, BENZYLAMINE, p-ISOPROPYL-N-OCTYL-, 4-Isopropyl-N-octylbenzenemethanamine, BENZYLAMINE,p-ISOPROPYL-N-OCTYL
| Molecular Formula | C18H31N |
|---|---|
| Molecular Weight | 261.25 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 10 |
| Exact Mass | 261.24564 |
| Heavy Atoms | 19 |
| Complexity | 192.0 |
Chemical Identifiers
| CAS Number | 63991-64-0 |
|---|---|
| SMILES | CCCCCCCCNCC1=CC=C(C=C1)C(C)C |
| InChIKey | GFJYNQALVNKHCS-UHFFFAOYSA-N |
Product Overview
对异丙基-N-辛基苄胺 (CAS 63991-64-0), with molecular formula C18H31N and molecular weight 261.25 g/mol. IUPAC: N-[(4-propan-2-ylphenyl)methyl]octan-1-amine.
Chemical Property Profile of 对异丙基-N-辛基苄胺
Property Insights of 对异丙基-N-辛基苄胺
The XLogP value of 5.8 indicates that 对异丙基-N-辛基苄胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, 对异丙基-N-辛基苄胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 对异丙基-N-辛基苄胺 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 对异丙基-N-辛基苄胺?
The CAS number of 对异丙基-N-辛基苄胺 is 63991-64-0.
What is the molecular formula of 对异丙基-N-辛基苄胺?
The molecular formula of 对异丙基-N-辛基苄胺 is C18H31N.
What is the molecular weight of 对异丙基-N-辛基苄胺?
The molecular weight of 对异丙基-N-辛基苄胺 is 261.25 g/mol.
Where can I buy 对异丙基-N-辛基苄胺?
You can request a quote for 对异丙基-N-辛基苄胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 对异丙基-N-辛基苄胺?
Yes, KEHONG BIO provides custom synthesis services for 对异丙基-N-辛基苄胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.