o-Acetotoluidide, 6'-chloro-2-(isopropylamino)-, hydrochloride
TL;DR: o-Acetotoluidide, 6'-chloro-2-(isopropylamino)-, hydrochloride (CAS 77966-61-1) is a chemical compound with molecular formula C12H18Cl2N2O and molecular weight 276.08 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]-propan-2-ylazanium chloride
Also Known As: C 3059, 2'-Chloro-2-(isopropylamino)-6'-methylacetanilide, hydrochloride, 6'-Chloro-2-(isopropylamino)-o-acetotoluidide, hydrochloride, o-ACETOTOLUIDIDE, 6'-CHLORO-2-(ISOPROPYLAMINO)-, HYDROCHLORIDE, [2-(2-chloro-6-methylanilino)-2-oxoethyl]-propan-2-ylazanium chloride
| Molecular Formula | C12H18Cl2N2O |
|---|---|
| Molecular Weight | 276.08 g/mol |
| LogP | -1.44 |
| Topological Polar Surface Area | 45.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.07962 |
| Heavy Atoms | 17 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 77966-61-1 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)Cl)NC(=O)C[NH2+]C(C)C.[Cl-] |
| InChIKey | KNOFTQBAKOZNQI-UHFFFAOYSA-N |
Product Overview
o-Acetotoluidide, 6'-chloro-2-(isopropylamino)-, hydrochloride (CAS 77966-61-1), with molecular formula C12H18Cl2N2O and molecular weight 276.08 g/mol. IUPAC: [2-(2-chloro-6-methylanilino)-2-oxoethyl]-propan-2-ylazanium chloride.
Chemical Property Profile of o-Acetotoluidide, 6'-chloro-2-(isopropylamino)-, hydrochloride
Property Insights of o-Acetotoluidide, 6'-chloro-2-(isopropylamino)-, hydrochloride
The XLogP value of -1.44 indicates that o-Acetotoluidide, 6'-chloro-2-(isopropylamino)-, 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-(isopropylamino)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, o-Acetotoluidide, 6'-chloro-2-(isopropylamino)-, 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-(isopropylamino)-, hydrochloride?
The CAS number of o-Acetotoluidide, 6'-chloro-2-(isopropylamino)-, hydrochloride is 77966-61-1.
What is the molecular formula of o-Acetotoluidide, 6'-chloro-2-(isopropylamino)-, hydrochloride?
The molecular formula of o-Acetotoluidide, 6'-chloro-2-(isopropylamino)-, hydrochloride is C12H18Cl2N2O.
What is the molecular weight of o-Acetotoluidide, 6'-chloro-2-(isopropylamino)-, hydrochloride?
The molecular weight of o-Acetotoluidide, 6'-chloro-2-(isopropylamino)-, hydrochloride is 276.08 g/mol.
Where can I buy o-Acetotoluidide, 6'-chloro-2-(isopropylamino)-, hydrochloride?
You can request a quote for o-Acetotoluidide, 6'-chloro-2-(isopropylamino)-, 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-(isopropylamino)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for o-Acetotoluidide, 6'-chloro-2-(isopropylamino)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.