Aniline, N-tert-butyl-3-chloro-
TL;DR: Aniline, N-tert-butyl-3-chloro- (CAS 19088-39-2) is a chemical compound with molecular formula C10H14ClN and molecular weight 183.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-tert-butyl-3-chloroaniline
Also Known As: N-tert-butyl-3-chloroaniline, N-tert-Butyl 3-chloroaniline, Aniline, N-tert-butyl-3-chloro-, (tert-butyl)(3-chlorophenyl)amine, N-(tert-butyl)-N-(3-chlorophenyl)amine
| Molecular Formula | C10H14ClN |
|---|---|
| Molecular Weight | 183.08 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 183.08148 |
| Heavy Atoms | 12 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 19088-39-2 |
|---|---|
| SMILES | CC(C)(C)NC1=CC(=CC=C1)Cl |
| InChIKey | LDAXLSHIKGKJCN-UHFFFAOYSA-N |
Product Overview
Aniline, N-tert-butyl-3-chloro- (CAS 19088-39-2), with molecular formula C10H14ClN and molecular weight 183.08 g/mol. IUPAC: N-tert-butyl-3-chloroaniline.
Chemical Property Profile of Aniline, N-tert-butyl-3-chloro-
Property Insights of Aniline, N-tert-butyl-3-chloro-
The XLogP value of 3.5 indicates that Aniline, N-tert-butyl-3-chloro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, Aniline, N-tert-butyl-3-chloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aniline, N-tert-butyl-3-chloro- 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 Aniline, N-tert-butyl-3-chloro-?
The CAS number of Aniline, N-tert-butyl-3-chloro- is 19088-39-2.
What is the molecular formula of Aniline, N-tert-butyl-3-chloro-?
The molecular formula of Aniline, N-tert-butyl-3-chloro- is C10H14ClN.
What is the molecular weight of Aniline, N-tert-butyl-3-chloro-?
The molecular weight of Aniline, N-tert-butyl-3-chloro- is 183.08 g/mol.
Where can I buy Aniline, N-tert-butyl-3-chloro-?
You can request a quote for Aniline, N-tert-butyl-3-chloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aniline, N-tert-butyl-3-chloro-?
Yes, KEHONG BIO provides custom synthesis services for Aniline, N-tert-butyl-3-chloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.