4,5-二氯-6-甲基-1,3-苯二胺
TL;DR: 4,5-二氯-6-甲基-1,3-苯二胺 (CAS 50694-83-2) is a chemical compound with molecular formula C7H8Cl2N2 and molecular weight 190.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-二氯-6-甲基-1,3-苯二胺
4,5-dichloro-6-methylbenzene-1,3-diamine
Also Known As: 4,5-dichloro-6-methylbenzene-1,3-diamine, 1,3-Benzenediamine, 4,5-dichloro-6-methyl-, 5,6-Dichloro-2,4-toluenediamine, 4,5-dichloro-6-methyl-benzene-1,3-diamine, J1.619.425E
| Molecular Formula | C7H8Cl2N2 |
|---|---|
| Molecular Weight | 190.01 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 190.00645 |
| Heavy Atoms | 11 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 50694-83-2 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1N)N)Cl)Cl |
| InChIKey | FOEUWVULONMTDC-UHFFFAOYSA-N |
Product Overview
4,5-二氯-6-甲基-1,3-苯二胺 (CAS 50694-83-2), with molecular formula C7H8Cl2N2 and molecular weight 190.01 g/mol. IUPAC: 4,5-dichloro-6-methylbenzene-1,3-diamine.
Chemical Property Profile of 4,5-二氯-6-甲基-1,3-苯二胺
Property Insights of 4,5-二氯-6-甲基-1,3-苯二胺
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-二氯-6-甲基-1,3-苯二胺. With a topological polar surface area (TPSA) of 52.0 Ų, 4,5-二氯-6-甲基-1,3-苯二胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-二氯-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 4,5-二氯-6-甲基-1,3-苯二胺?
The CAS number of 4,5-二氯-6-甲基-1,3-苯二胺 is 50694-83-2.
What is the molecular formula of 4,5-二氯-6-甲基-1,3-苯二胺?
The molecular formula of 4,5-二氯-6-甲基-1,3-苯二胺 is C7H8Cl2N2.
What is the molecular weight of 4,5-二氯-6-甲基-1,3-苯二胺?
The molecular weight of 4,5-二氯-6-甲基-1,3-苯二胺 is 190.01 g/mol.
Where can I buy 4,5-二氯-6-甲基-1,3-苯二胺?
You can request a quote for 4,5-二氯-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 4,5-二氯-6-甲基-1,3-苯二胺?
Yes, KEHONG BIO provides custom synthesis services for 4,5-二氯-6-甲基-1,3-苯二胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.