Aniline, N-(2-chloroethyl)-
TL;DR: Aniline, N-(2-chloroethyl)- (CAS 935-06-8) is a chemical compound with molecular formula C8H10ClN and molecular weight 155.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-chloroethyl)aniline
Also Known As: N-(2-Chloroethyl)aniline, N-(Chloroethyl)aniline, N-(2-Chloroethyl)benzenamine, N-2-chloroethylaniline, Benzenamine, N-(2-chloroethyl)-
| Molecular Formula | C8H10ClN |
|---|---|
| Molecular Weight | 155.05 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 155.05017 |
| Heavy Atoms | 10 |
| Complexity | 79.0 |
Chemical Identifiers
| CAS Number | 935-06-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)NCCCl |
| InChIKey | KTDILAZSFSAPMD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Aniline, N-(2-chloroethyl)- (CAS 935-06-8), with molecular formula C8H10ClN and molecular weight 155.05 g/mol. IUPAC: N-(2-chloroethyl)aniline.
Chemical Property Profile of Aniline, N-(2-chloroethyl)-
Property Insights of Aniline, N-(2-chloroethyl)-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aniline, N-(2-chloroethyl)-. With a topological polar surface area (TPSA) of 12.0 Ų, Aniline, N-(2-chloroethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aniline, N-(2-chloroethyl)- has 1 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 Aniline, N-(2-chloroethyl)-?
The CAS number of Aniline, N-(2-chloroethyl)- is 935-06-8.
What is the molecular formula of Aniline, N-(2-chloroethyl)-?
The molecular formula of Aniline, N-(2-chloroethyl)- is C8H10ClN.
What is the molecular weight of Aniline, N-(2-chloroethyl)-?
The molecular weight of Aniline, N-(2-chloroethyl)- is 155.05 g/mol.
Where can I buy Aniline, N-(2-chloroethyl)-?
You can request a quote for Aniline, N-(2-chloroethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aniline, N-(2-chloroethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Aniline, N-(2-chloroethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.