2-Bromo-5-chloro-4-methylaniline
TL;DR: 2-Bromo-5-chloro-4-methylaniline (CAS 102170-52-5) is a chemical compound with molecular formula C7H7BrClN and molecular weight 218.94504 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-bromo-5-chloro-4-methylaniline
Also Known As: 2-bromo-5-chloro-4-methylaniline, 2-BROMO-5-CHLORO-4-METHYL-ANILINE, 2-p-tolylpropan-2-amine, 4-Amino-5-bromo-2-chlorotoluene, Benzenamine, 2-bromo-5-chloro-4-methyl-
Technical Specifications
| Molecular Formula | C7H7BrClN |
| Molecular Weight | 218.94504 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 218.94504 Da |
| Heavy Atoms | 10 |
| Complexity | 120.0 |
| SMILES | CC1=CC(=C(C=C1Cl)N)Br |
| InChIKey | ULCBEYQOSOVMMA-UHFFFAOYSA-N |
Chemical Property Profile of 2-Bromo-5-chloro-4-methylaniline
Property Insights of 2-Bromo-5-chloro-4-methylaniline
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-5-chloro-4-methylaniline. With a topological polar surface area (TPSA) of 26.0 Ų, 2-Bromo-5-chloro-4-methylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-5-chloro-4-methylaniline 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
What is the CAS number of 2-Bromo-5-chloro-4-methylaniline?
The CAS number of 2-Bromo-5-chloro-4-methylaniline is 102170-52-5.
What is the molecular formula of 2-Bromo-5-chloro-4-methylaniline?
The molecular formula of 2-Bromo-5-chloro-4-methylaniline is C7H7BrClN.
What is the molecular weight of 2-Bromo-5-chloro-4-methylaniline?
The molecular weight of 2-Bromo-5-chloro-4-methylaniline is 218.94504 g/mol.
Where can I buy 2-Bromo-5-chloro-4-methylaniline?
You can request a quote for 2-Bromo-5-chloro-4-methylaniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Bromo-5-chloro-4-methylaniline?
Yes, CoreyChem provides custom synthesis services for 2-Bromo-5-chloro-4-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.