o-Acetotoluidide, 6'-chloro-2-(isobutylamino)-, hydrochloride
TL;DR: o-Acetotoluidide, 6'-chloro-2-(isobutylamino)-, hydrochloride (CAS 102489-59-8) is a chemical compound with molecular formula C13H20Cl2N2O and molecular weight 290.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(2-chloro-6-methylanilino)-2-oxoethyl]-(2-methylpropyl)azanium chloride
Also Known As: C 3156, 6'-Chloro-2-(isobutylamino)-o-acetotoluidide, hydrochloride, o-ACETOTOLUIDIDE, 6'-CHLORO-2-(ISOBUTYLAMINO)-, HYDROCHLORIDE, [2-(2-Chloro-6-methylanilino)-2-oxoethyl]-(2-methylpropyl)azaniumchloride, [2-(2-chloro-6-methylanilino)-2-oxoethyl]-(2-methylpropyl)azanium
| Molecular Formula | C13H20Cl2N2O |
|---|---|
| Molecular Weight | 290.10 g/mol |
| LogP | -1.19 |
| Topological Polar Surface Area | 45.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 290.09528 |
| Heavy Atoms | 18 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 102489-59-8 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)Cl)NC(=O)C[NH2+]CC(C)C.[Cl-] |
| InChIKey | RQHKHHVVMLJTSR-UHFFFAOYSA-N |
Product Overview
o-Acetotoluidide, 6'-chloro-2-(isobutylamino)-, hydrochloride (CAS 102489-59-8), with molecular formula C13H20Cl2N2O and molecular weight 290.10 g/mol. IUPAC: [2-(2-chloro-6-methylanilino)-2-oxoethyl]-(2-methylpropyl)azanium chloride.
Chemical Property Profile of o-Acetotoluidide, 6'-chloro-2-(isobutylamino)-, hydrochloride
Property Insights of o-Acetotoluidide, 6'-chloro-2-(isobutylamino)-, hydrochloride
The XLogP value of -1.19 indicates that o-Acetotoluidide, 6'-chloro-2-(isobutylamino)-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 45.7 Ų, o-Acetotoluidide, 6'-chloro-2-(isobutylamino)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, o-Acetotoluidide, 6'-chloro-2-(isobutylamino)-, hydrochloride has 2 hydrogen bond donor(s) and 2 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 o-Acetotoluidide, 6'-chloro-2-(isobutylamino)-, hydrochloride?
The CAS number of o-Acetotoluidide, 6'-chloro-2-(isobutylamino)-, hydrochloride is 102489-59-8.
What is the molecular formula of o-Acetotoluidide, 6'-chloro-2-(isobutylamino)-, hydrochloride?
The molecular formula of o-Acetotoluidide, 6'-chloro-2-(isobutylamino)-, hydrochloride is C13H20Cl2N2O.
What is the molecular weight of o-Acetotoluidide, 6'-chloro-2-(isobutylamino)-, hydrochloride?
The molecular weight of o-Acetotoluidide, 6'-chloro-2-(isobutylamino)-, hydrochloride is 290.10 g/mol.
Where can I buy o-Acetotoluidide, 6'-chloro-2-(isobutylamino)-, hydrochloride?
You can request a quote for o-Acetotoluidide, 6'-chloro-2-(isobutylamino)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for o-Acetotoluidide, 6'-chloro-2-(isobutylamino)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for o-Acetotoluidide, 6'-chloro-2-(isobutylamino)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.