2-Amino-3,5-dichlorobenzonitrile
TL;DR: 2-Amino-3,5-dichlorobenzonitrile (CAS 37007-70-8) is a chemical compound with molecular formula C7H4Cl2N2 and molecular weight 185.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-3,5-dichlorobenzonitrile
Also Known As: 2-Amino-3,5-dichlorobenzonitrile, null, 2-Amino-3,5-dichloro-benzonitrile, 3,5-Dichloroanthranilonitrile, 2-Amino-3.5-dichlorbenzonitril
| Molecular Formula | C7H4Cl2N2 |
|---|---|
| Molecular Weight | 185.98 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 185.97516 |
| Heavy Atoms | 11 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 37007-70-8 |
|---|---|
| SMILES | C1=C(C=C(C(=C1C#N)N)Cl)Cl |
| InChIKey | ZHKNDJRPOVUPMT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Amino-3,5-dichlorobenzonitrile (CAS 37007-70-8), with molecular formula C7H4Cl2N2 and molecular weight 185.98 g/mol. IUPAC: 2-amino-3,5-dichlorobenzonitrile.
Chemical Property Profile of 2-Amino-3,5-dichlorobenzonitrile
Property Insights of 2-Amino-3,5-dichlorobenzonitrile
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Amino-3,5-dichlorobenzonitrile. With a topological polar surface area (TPSA) of 49.8 Ų, 2-Amino-3,5-dichlorobenzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Amino-3,5-dichlorobenzonitrile has 1 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 2-Amino-3,5-dichlorobenzonitrile?
The CAS number of 2-Amino-3,5-dichlorobenzonitrile is 37007-70-8.
What is the molecular formula of 2-Amino-3,5-dichlorobenzonitrile?
The molecular formula of 2-Amino-3,5-dichlorobenzonitrile is C7H4Cl2N2.
What is the molecular weight of 2-Amino-3,5-dichlorobenzonitrile?
The molecular weight of 2-Amino-3,5-dichlorobenzonitrile is 185.98 g/mol.
Where can I buy 2-Amino-3,5-dichlorobenzonitrile?
You can request a quote for 2-Amino-3,5-dichlorobenzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-3,5-dichlorobenzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-3,5-dichlorobenzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.