鄰氨基苯甲醚
TL;DR: 鄰氨基苯甲醚 (CAS 90-04-0) is a chemical compound with molecular formula C7H9NO and molecular weight 123.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
鄰氨基苯甲醚
2-methoxyaniline
Also Known As: O-ANISIDINE, 2-Methoxyaniline, 2-Anisidine, 2-Aminoanisole, o-Aminoanisole
| Molecular Formula | C7H9NO |
|---|---|
| Molecular Weight | 123.07 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 123.06841 |
| Heavy Atoms | 9 |
| Complexity | 85.0 |
| Melting Point | 5.0 °C |
| Boiling Point | 225.0 °C at 760 mmHg |
| Density | 1.0923 at 20.0 °C |
| Solubility | less than 0.1 mg/mL at 66 °F (NTP, 1992) |
| Flash Point | 98.9 °C |
| Vapor Pressure | less than 0.1 mmHg at 20.0 °C ; 1 mmHg at 61.0 °C |
| Refractive Index | 1.5715 at 10 °C |
Chemical Identifiers
| CAS Number | 90-04-0 |
|---|---|
| SMILES | COC1=CC=CC=C1N |
| InChIKey | VMPITZXILSNTON-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
鄰氨基苯甲醚 (CAS 90-04-0), with molecular formula C7H9NO and molecular weight 123.07 g/mol. IUPAC: 2-methoxyaniline.
Chemical Property Profile of 鄰氨基苯甲醚
Property Insights of 鄰氨基苯甲醚
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 鄰氨基苯甲醚. With a topological polar surface area (TPSA) of 35.3 Ų, 鄰氨基苯甲醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 鄰氨基苯甲醚 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 鄰氨基苯甲醚?
The CAS number of 鄰氨基苯甲醚 is 90-04-0.
What is the molecular formula of 鄰氨基苯甲醚?
The molecular formula of 鄰氨基苯甲醚 is C7H9NO.
What is the molecular weight of 鄰氨基苯甲醚?
The molecular weight of 鄰氨基苯甲醚 is 123.07 g/mol.
Where can I buy 鄰氨基苯甲醚?
You can request a quote for 鄰氨基苯甲醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 鄰氨基苯甲醚?
Yes, KEHONG BIO provides custom synthesis services for 鄰氨基苯甲醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.