Benzenamine, 4-((2-amino-3-chlorophenyl)methyl)-2-chloro-
TL;DR: Benzenamine, 4-((2-amino-3-chlorophenyl)methyl)-2-chloro- (CAS 3813-13-6) is a chemical compound with molecular formula C13H12Cl2N2 and molecular weight 266.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-amino-3-chlorophenyl)methyl]-6-chloroaniline
Also Known As: 2',6-Dichloro-2,4'-methylenedianiline, Aniline, 2',6-dichloro-2,4'-methylenedi-, 4-(2-amino-3-chlorobenzyl)-2-chloroaniline, Benzenamine, 4-[(2-amino-3-chlorophenyl)methyl]-2-chloro-, 2-[(4-amino-3-chlorophenyl)methyl]-6-chloroaniline
| Molecular Formula | C13H12Cl2N2 |
|---|---|
| Molecular Weight | 266.04 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 52.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.03775 |
| Heavy Atoms | 17 |
| Complexity | 250.0 |
Chemical Identifiers
| CAS Number | 3813-13-6 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)N)CC2=CC(=C(C=C2)N)Cl |
| InChIKey | OWESKDKDULSMLC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Benzenamine, 4-((2-amino-3-chlorophenyl)methyl)-2-chloro- (CAS 3813-13-6), with molecular formula C13H12Cl2N2 and molecular weight 266.04 g/mol. IUPAC: 2-[(4-amino-3-chlorophenyl)methyl]-6-chloroaniline.
Chemical Property Profile of Benzenamine, 4-((2-amino-3-chlorophenyl)methyl)-2-chloro-
Property Insights of Benzenamine, 4-((2-amino-3-chlorophenyl)methyl)-2-chloro-
The XLogP value of 3.7 indicates that Benzenamine, 4-((2-amino-3-chlorophenyl)methyl)-2-chloro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.0 Ų, Benzenamine, 4-((2-amino-3-chlorophenyl)methyl)-2-chloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenamine, 4-((2-amino-3-chlorophenyl)methyl)-2-chloro- 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 Benzenamine, 4-((2-amino-3-chlorophenyl)methyl)-2-chloro-?
The CAS number of Benzenamine, 4-((2-amino-3-chlorophenyl)methyl)-2-chloro- is 3813-13-6.
What is the molecular formula of Benzenamine, 4-((2-amino-3-chlorophenyl)methyl)-2-chloro-?
The molecular formula of Benzenamine, 4-((2-amino-3-chlorophenyl)methyl)-2-chloro- is C13H12Cl2N2.
What is the molecular weight of Benzenamine, 4-((2-amino-3-chlorophenyl)methyl)-2-chloro-?
The molecular weight of Benzenamine, 4-((2-amino-3-chlorophenyl)methyl)-2-chloro- is 266.04 g/mol.
Where can I buy Benzenamine, 4-((2-amino-3-chlorophenyl)methyl)-2-chloro-?
You can request a quote for Benzenamine, 4-((2-amino-3-chlorophenyl)methyl)-2-chloro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenamine, 4-((2-amino-3-chlorophenyl)methyl)-2-chloro-?
Yes, KEHONG BIO provides custom synthesis services for Benzenamine, 4-((2-amino-3-chlorophenyl)methyl)-2-chloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.