3-Hydroxy-N-phenylaniline
TL;DR: 3-Hydroxy-N-phenylaniline (CAS 101-18-8) is a chemical compound with molecular formula C12H11NO and molecular weight 185.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-anilinophenol
Also Known As: 3-Hydroxydiphenylamine, 3-(Phenylamino)phenol, 3-Anilinophenol, m-Anilinophenol, Phenol, 3-(phenylamino)-
| Molecular Formula | C12H11NO |
|---|---|
| Molecular Weight | 185.08 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 185.08406 |
| Heavy Atoms | 14 |
| Complexity | 166.0 |
| Melting Point | 178 to 82.2 °C |
| Boiling Point | 340.0 °C at 760 mmHg |
| Solubility | less than 1 mg/mL at 72.5 °F (NTP, 1992) |
Chemical Identifiers
| CAS Number | 101-18-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC2=CC(=CC=C2)O |
| InChIKey | NDACNGSDAFKTGE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Hydroxy-N-phenylaniline (CAS 101-18-8), with molecular formula C12H11NO and molecular weight 185.08 g/mol. IUPAC: 3-anilinophenol.
Chemical Property Profile of 3-Hydroxy-N-phenylaniline
Property Insights of 3-Hydroxy-N-phenylaniline
The XLogP value of 3.1 indicates that 3-Hydroxy-N-phenylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.3 Ų, 3-Hydroxy-N-phenylaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxy-N-phenylaniline has 2 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 3-Hydroxy-N-phenylaniline?
The CAS number of 3-Hydroxy-N-phenylaniline is 101-18-8.
What is the molecular formula of 3-Hydroxy-N-phenylaniline?
The molecular formula of 3-Hydroxy-N-phenylaniline is C12H11NO.
What is the molecular weight of 3-Hydroxy-N-phenylaniline?
The molecular weight of 3-Hydroxy-N-phenylaniline is 185.08 g/mol.
Where can I buy 3-Hydroxy-N-phenylaniline?
You can request a quote for 3-Hydroxy-N-phenylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxy-N-phenylaniline?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-N-phenylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.