4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine
TL;DR: 4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine (CAS 115084-47-4) is a chemical compound with molecular formula C13H12Cl2N2O and molecular weight 282.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[(4-amino-3-chlorophenyl)methyl]-2-chlorophenyl]hydroxylamine
Also Known As: N-Hydroxy-moca, NIOSH/NC3005000, N-Hydroxy-4,4'-methylenebis(2-chloroaniline), Benzenamine, 4-((4-amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxy-, 4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine
| Molecular Formula | C13H12Cl2N2O |
|---|---|
| Molecular Weight | 282.03 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 58.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.03265 |
| Heavy Atoms | 18 |
| Complexity | 267.0 |
Chemical Identifiers
| CAS Number | 115084-47-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1CC2=CC(=C(C=C2)NO)Cl)Cl)N |
| InChIKey | FBTJXIHXAORGIR-UHFFFAOYSA-N |
Product Overview
4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine (CAS 115084-47-4), with molecular formula C13H12Cl2N2O and molecular weight 282.03 g/mol. IUPAC: N-[4-[(4-amino-3-chlorophenyl)methyl]-2-chlorophenyl]hydroxylamine.
Chemical Property Profile of 4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine
Property Insights of 4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine
The XLogP value of 3.9 indicates that 4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.3 Ų, 4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine has 3 hydrogen bond donor(s) and 3 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 4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine?
The CAS number of 4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine is 115084-47-4.
What is the molecular formula of 4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine?
The molecular formula of 4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine is C13H12Cl2N2O.
What is the molecular weight of 4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine?
The molecular weight of 4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine is 282.03 g/mol.
Where can I buy 4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine?
You can request a quote for 4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine?
Yes, KEHONG BIO provides custom synthesis services for 4-((4-Amino-3-chlorophenyl)methyl)-2-chloro-N-hydroxybenzenamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.