羰基氰化物间氯苯腙
TL;DR: 羰基氰化物间氯苯腙 (CAS 555-60-2) is a chemical compound with molecular formula C9H5ClN4 and molecular weight 204.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
羰基氰化物间氯苯腙
2-[(3-chlorophenyl)hydrazinylidene]propanedinitrile
Also Known As: cccp, (3-Chlorophenyl)hydrazonomalononitrile, m-Cl-CCP, Carbonyl cyanide 3-chlorophenylhydrazone, Carbonyl cyanide m-chlorophenylhydrazone
| Molecular Formula | C9H5ClN4 |
|---|---|
| Molecular Weight | 204.02 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 72.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 204.02028 |
| Heavy Atoms | 14 |
| Complexity | 300.0 |
| Vapor Pressure | 0.00000567 [mmHg] |
Chemical Identifiers
| CAS Number | 555-60-2 |
|---|---|
| SMILES | C1=CC(=CC(=C1)Cl)NN=C(C#N)C#N |
| InChIKey | UGTJLJZQQFGTJD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
羰基氰化物间氯苯腙 (CAS 555-60-2), with molecular formula C9H5ClN4 and molecular weight 204.02 g/mol. IUPAC: 2-[(3-chlorophenyl)hydrazinylidene]propanedinitrile.
Chemical Property Profile of 羰基氰化物间氯苯腙
Property Insights of 羰基氰化物间氯苯腙
The XLogP value of 3.4 indicates that 羰基氰化物间氯苯腙 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 羰基氰化物间氯苯腙. Following Lipinski's Rule of Five, 羰基氰化物间氯苯腙 has 1 hydrogen bond donor(s) and 4 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 羰基氰化物间氯苯腙?
The CAS number of 羰基氰化物间氯苯腙 is 555-60-2.
What is the molecular formula of 羰基氰化物间氯苯腙?
The molecular formula of 羰基氰化物间氯苯腙 is C9H5ClN4.
What is the molecular weight of 羰基氰化物间氯苯腙?
The molecular weight of 羰基氰化物间氯苯腙 is 204.02 g/mol.
Where can I buy 羰基氰化物间氯苯腙?
You can request a quote for 羰基氰化物间氯苯腙 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 羰基氰化物间氯苯腙?
Yes, KEHONG BIO provides custom synthesis services for 羰基氰化物间氯苯腙 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.