N-(4-氯苯基)碳亚胺二酰氯
TL;DR: N-(4-氯苯基)碳亚胺二酰氯 (CAS 2771-67-7) is a chemical compound with molecular formula C7H4Cl3N and molecular weight 206.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-氯苯基)碳亚胺二酰氯
1,1-dichloro-N-(4-chlorophenyl)methanimine
Also Known As: N- -4-chloroaniline, Carbonimidic dichloride, (4-chlorophenyl)-, Carbonimidic dichloride, N-(4-chlorophenyl)-, (4-Chlorophenyl)carbonimidoyl, (4-chlorophenyl)carbonimidic dichloride
| Molecular Formula | C7H4Cl3N |
|---|---|
| Molecular Weight | 206.94 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 12.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.94093 |
| Heavy Atoms | 11 |
| Complexity | 146.0 |
Chemical Identifiers
| CAS Number | 2771-67-7 |
|---|---|
| SMILES | C1=CC(=CC=C1N=C(Cl)Cl)Cl |
| InChIKey | ZPOLQMXMBYFIFW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(4-氯苯基)碳亚胺二酰氯 (CAS 2771-67-7), with molecular formula C7H4Cl3N and molecular weight 206.94 g/mol. IUPAC: 1,1-dichloro-N-(4-chlorophenyl)methanimine.
Chemical Property Profile of N-(4-氯苯基)碳亚胺二酰氯
Property Insights of N-(4-氯苯基)碳亚胺二酰氯
The XLogP value of 4.3 indicates that N-(4-氯苯基)碳亚胺二酰氯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.4 Ų, N-(4-氯苯基)碳亚胺二酰氯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-氯苯基)碳亚胺二酰氯 has 0 hydrogen bond donor(s) and 1 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 N-(4-氯苯基)碳亚胺二酰氯?
The CAS number of N-(4-氯苯基)碳亚胺二酰氯 is 2771-67-7.
What is the molecular formula of N-(4-氯苯基)碳亚胺二酰氯?
The molecular formula of N-(4-氯苯基)碳亚胺二酰氯 is C7H4Cl3N.
What is the molecular weight of N-(4-氯苯基)碳亚胺二酰氯?
The molecular weight of N-(4-氯苯基)碳亚胺二酰氯 is 206.94 g/mol.
Where can I buy N-(4-氯苯基)碳亚胺二酰氯?
You can request a quote for N-(4-氯苯基)碳亚胺二酰氯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-氯苯基)碳亚胺二酰氯?
Yes, KEHONG BIO provides custom synthesis services for N-(4-氯苯基)碳亚胺二酰氯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.