N,N-二异丙基苯胺
TL;DR: N,N-二异丙基苯胺 (CAS 4107-98-6) is a chemical compound with molecular formula C12H19N and molecular weight 177.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-二异丙基苯胺
N,N-di(propan-2-yl)aniline
Also Known As: N,N-DIISOPROPYLANILINE, diisopropylaniline, N,N-di(propan-2-yl)aniline, N,N-bis(propan-2-yl)aniline, diisopropylphenyl amine
| Molecular Formula | C12H19N |
|---|---|
| Molecular Weight | 177.15 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 177.15175 |
| Heavy Atoms | 13 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 4107-98-6 |
|---|---|
| SMILES | CC(C)N(C1=CC=CC=C1)C(C)C |
| InChIKey | OVSARSKQWCLSJT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-二异丙基苯胺 (CAS 4107-98-6), with molecular formula C12H19N and molecular weight 177.15 g/mol. IUPAC: N,N-di(propan-2-yl)aniline.
Chemical Property Profile of N,N-二异丙基苯胺
Property Insights of N,N-二异丙基苯胺
The XLogP value of 3.6 indicates that N,N-二异丙基苯胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, N,N-二异丙基苯胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-二异丙基苯胺 has 0 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,N-二异丙基苯胺?
The CAS number of N,N-二异丙基苯胺 is 4107-98-6.
What is the molecular formula of N,N-二异丙基苯胺?
The molecular formula of N,N-二异丙基苯胺 is C12H19N.
What is the molecular weight of N,N-二异丙基苯胺?
The molecular weight of N,N-二异丙基苯胺 is 177.15 g/mol.
Where can I buy N,N-二异丙基苯胺?
You can request a quote for N,N-二异丙基苯胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-二异丙基苯胺?
Yes, KEHONG BIO provides custom synthesis services for N,N-二异丙基苯胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.