CS催淚性毒氣
TL;DR: CS催淚性毒氣 (CAS 2698-41-1) is a chemical compound with molecular formula C10H5ClN2 and molecular weight 188.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
CS催淚性毒氣
2-[(2-chlorophenyl)methylidene]propanedinitrile
Also Known As: Alonitrile, 2-Chlorobenzylidenemalononitrile, 2-Chlorobmn, CS (lacrimator), 2-(2-Chlorobenzylidene)malononitrile
| Molecular Formula | C10H5ClN2 |
|---|---|
| Molecular Weight | 188.01 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.01413 |
| Heavy Atoms | 13 |
| Complexity | 283.0 |
| Melting Point | 95.0 °C |
| Boiling Point | 590 to 315.0 °C at 760 mmHg |
| Solubility | 1 to 5 mg/mL at 61 °F (NTP, 1992) |
| Vapor Pressure | 3.4e-05 mmHg at 20.0 °C |
Chemical Identifiers
| CAS Number | 2698-41-1 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C=C(C#N)C#N)Cl |
| InChIKey | JJNZXLAFIPKXIG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
CS催淚性毒氣 (CAS 2698-41-1), with molecular formula C10H5ClN2 and molecular weight 188.01 g/mol. IUPAC: 2-[(2-chlorophenyl)methylidene]propanedinitrile.
Chemical Property Profile of CS催淚性毒氣
Property Insights of CS催淚性毒氣
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CS催淚性毒氣. With a topological polar surface area (TPSA) of 47.6 Ų, CS催淚性毒氣 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CS催淚性毒氣 has 0 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 CS催淚性毒氣?
The CAS number of CS催淚性毒氣 is 2698-41-1.
What is the molecular formula of CS催淚性毒氣?
The molecular formula of CS催淚性毒氣 is C10H5ClN2.
What is the molecular weight of CS催淚性毒氣?
The molecular weight of CS催淚性毒氣 is 188.01 g/mol.
Where can I buy CS催淚性毒氣?
You can request a quote for CS催淚性毒氣 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CS催淚性毒氣?
Yes, KEHONG BIO provides custom synthesis services for CS催淚性毒氣 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.