6'-Chloro-ortho-crotonotoluidide
TL;DR: 6'-Chloro-ortho-crotonotoluidide (CAS 99859-68-4) is a chemical compound with molecular formula C11H12ClNO and molecular weight 209.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chloro-6-methylphenyl)but-2-enamide
Also Known As: 6'-CHLORO-ORTHO-CROTONOTOLUIDIDE, N-(2-chloro-6-methylphenyl)but-2-enamide, crotonic acid-(2-chloro-6-methyl-anilide), N-(2-chloro-6-methyl-phenyl)but-2-enamide
| Molecular Formula | C11H12ClNO |
|---|---|
| Molecular Weight | 209.06 g/mol |
| LogP | 3.16302 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 209.06075 |
| Heavy Atoms | 14 |
| Complexity | 351.30032 |
Chemical Identifiers
| CAS Number | 99859-68-4 |
|---|---|
| SMILES | CC=CC(=O)NC1=C(C=CC=C1Cl)C |
Product Overview
6'-Chloro-ortho-crotonotoluidide (CAS 99859-68-4), with molecular formula C11H12ClNO and molecular weight 209.06 g/mol. IUPAC: N-(2-chloro-6-methylphenyl)but-2-enamide.
Chemical Property Profile of 6'-Chloro-ortho-crotonotoluidide
Property Insights of 6'-Chloro-ortho-crotonotoluidide
The XLogP value of 3.16302 indicates that 6'-Chloro-ortho-crotonotoluidide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.1 Ų, 6'-Chloro-ortho-crotonotoluidide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6'-Chloro-ortho-crotonotoluidide 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 6'-Chloro-ortho-crotonotoluidide?
The CAS number of 6'-Chloro-ortho-crotonotoluidide is 99859-68-4.
What is the molecular formula of 6'-Chloro-ortho-crotonotoluidide?
The molecular formula of 6'-Chloro-ortho-crotonotoluidide is C11H12ClNO.
What is the molecular weight of 6'-Chloro-ortho-crotonotoluidide?
The molecular weight of 6'-Chloro-ortho-crotonotoluidide is 209.06 g/mol.
Where can I buy 6'-Chloro-ortho-crotonotoluidide?
You can request a quote for 6'-Chloro-ortho-crotonotoluidide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6'-Chloro-ortho-crotonotoluidide?
Yes, KEHONG BIO provides custom synthesis services for 6'-Chloro-ortho-crotonotoluidide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.