Aniline, 3-chloro-2-methoxy-
TL;DR: Aniline, 3-chloro-2-methoxy- (CAS 51114-68-2) is a chemical compound with molecular formula C7H8ClNO and molecular weight 157.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-2-methoxyaniline
Also Known As: 3-Chloro-2-methoxyaniline, 3-Chloro-o-anisidine, 2-amino-6-chloroanisole, salzsaures o-Anisidin, Benzenamine, 3-chloro-2-methoxy-
| Molecular Formula | C7H8ClNO |
|---|---|
| Molecular Weight | 157.03 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 157.02943 |
| Heavy Atoms | 10 |
| Complexity | 110.0 |
Chemical Identifiers
| CAS Number | 51114-68-2 |
|---|---|
| SMILES | COC1=C(C=CC=C1Cl)N |
| InChIKey | VPZJHTWLWKFPQW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Aniline, 3-chloro-2-methoxy- (CAS 51114-68-2), with molecular formula C7H8ClNO and molecular weight 157.03 g/mol. IUPAC: 3-chloro-2-methoxyaniline.
Chemical Property Profile of Aniline, 3-chloro-2-methoxy-
Property Insights of Aniline, 3-chloro-2-methoxy-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aniline, 3-chloro-2-methoxy-. With a topological polar surface area (TPSA) of 35.3 Ų, Aniline, 3-chloro-2-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Aniline, 3-chloro-2-methoxy- has 1 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 Aniline, 3-chloro-2-methoxy-?
The CAS number of Aniline, 3-chloro-2-methoxy- is 51114-68-2.
What is the molecular formula of Aniline, 3-chloro-2-methoxy-?
The molecular formula of Aniline, 3-chloro-2-methoxy- is C7H8ClNO.
What is the molecular weight of Aniline, 3-chloro-2-methoxy-?
The molecular weight of Aniline, 3-chloro-2-methoxy- is 157.03 g/mol.
Where can I buy Aniline, 3-chloro-2-methoxy-?
You can request a quote for Aniline, 3-chloro-2-methoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aniline, 3-chloro-2-methoxy-?
Yes, KEHONG BIO provides custom synthesis services for Aniline, 3-chloro-2-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.