4-氯-6-甲基-1,3-苯二胺
TL;DR: 4-氯-6-甲基-1,3-苯二胺 (CAS 43216-72-4) is a chemical compound with molecular formula C7H9ClN2 and molecular weight 156.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氯-6-甲基-1,3-苯二胺
4-chloro-6-methylbenzene-1,3-diamine
Also Known As: 5-Chloro-2,4-toluenediamine, 4-chloro-6-methylbenzene-1,3-diamine, 1,3-Benzenediamine, 4-chloro-6-methyl-, 2,4-diamino-5-chlorotoluene, 5-chloro-2,4-diaminotoluene
| Molecular Formula | C7H9ClN2 |
|---|---|
| Molecular Weight | 156.05 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 156.04543 |
| Heavy Atoms | 10 |
| Complexity | 118.0 |
Chemical Identifiers
| CAS Number | 43216-72-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1N)N)Cl |
| InChIKey | MYFJHUCULJNTOF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-氯-6-甲基-1,3-苯二胺 (CAS 43216-72-4), with molecular formula C7H9ClN2 and molecular weight 156.05 g/mol. IUPAC: 4-chloro-6-methylbenzene-1,3-diamine.
Chemical Property Profile of 4-氯-6-甲基-1,3-苯二胺
Property Insights of 4-氯-6-甲基-1,3-苯二胺
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-氯-6-甲基-1,3-苯二胺. With a topological polar surface area (TPSA) of 52.0 Ų, 4-氯-6-甲基-1,3-苯二胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-氯-6-甲基-1,3-苯二胺 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 4-氯-6-甲基-1,3-苯二胺?
The CAS number of 4-氯-6-甲基-1,3-苯二胺 is 43216-72-4.
What is the molecular formula of 4-氯-6-甲基-1,3-苯二胺?
The molecular formula of 4-氯-6-甲基-1,3-苯二胺 is C7H9ClN2.
What is the molecular weight of 4-氯-6-甲基-1,3-苯二胺?
The molecular weight of 4-氯-6-甲基-1,3-苯二胺 is 156.05 g/mol.
Where can I buy 4-氯-6-甲基-1,3-苯二胺?
You can request a quote for 4-氯-6-甲基-1,3-苯二胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氯-6-甲基-1,3-苯二胺?
Yes, KEHONG BIO provides custom synthesis services for 4-氯-6-甲基-1,3-苯二胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.