4-Chloro-N,N-dimethylaniline
TL;DR: 4-Chloro-N,N-dimethylaniline (CAS 37762-99-5) is a chemical compound with molecular formula CN(C)C1=CC=C(C=C1)Cl and molecular weight 155.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-N,N-dimethylaniline
Also Known As: 4-Chloro-N,N-dimethylaniline, Benzenamine, 4-chloro-N,N-dimethyl-, 4-chloro-(dimethyl)aniline, p-chloro-n,n-dimethylaniline, p-Chlorophenyldimethylamine
| Molecular Formula | CN(C)C1=CC=C(C=C1)Cl |
|---|---|
| Molecular Weight | 155.05 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 155.05017 |
| Heavy Atoms | 10 |
| Complexity | 95.0 |
Chemical Identifiers
| CAS Number | 37762-99-5 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)Cl |
| InChIKey | IONGEXNDPXANJD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Chloro-N,N-dimethylaniline (CAS 37762-99-5), with molecular formula CN(C)C1=CC=C(C=C1)Cl and molecular weight 155.05 g/mol. IUPAC: 4-chloro-N,N-dimethylaniline.
Chemical Property Profile of 4-Chloro-N,N-dimethylaniline
Property Insights of 4-Chloro-N,N-dimethylaniline
The XLogP value of 3.1 indicates that 4-Chloro-N,N-dimethylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.2 Ų, 4-Chloro-N,N-dimethylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Chloro-N,N-dimethylaniline 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 4-Chloro-N,N-dimethylaniline?
The CAS number of 4-Chloro-N,N-dimethylaniline is 37762-99-5.
What is the molecular formula of 4-Chloro-N,N-dimethylaniline?
The molecular formula of 4-Chloro-N,N-dimethylaniline is CN(C)C1=CC=C(C=C1)Cl.
What is the molecular weight of 4-Chloro-N,N-dimethylaniline?
The molecular weight of 4-Chloro-N,N-dimethylaniline is 155.05 g/mol.
Where can I buy 4-Chloro-N,N-dimethylaniline?
You can request a quote for 4-Chloro-N,N-dimethylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Chloro-N,N-dimethylaniline?
Yes, KEHONG BIO provides custom synthesis services for 4-Chloro-N,N-dimethylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.