Alpha-(5-nitro-O-tolylimino)-O-cresol
TL;DR: Alpha-(5-nitro-O-tolylimino)-O-cresol (CAS 67912-41-8) is a chemical compound with molecular formula C14H12N2O3 and molecular weight 256.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-methyl-5-nitrophenyl)iminomethyl]phenol
Also Known As: ALPHA-(5-NITRO-O-TOLYLIMINO)-O-CRESOL, 2-{[(2-methyl-5-nitrophenyl)imino]methyl}phenol, 2-{(E)-[(2-methyl-5-nitrophenyl)imino]methyl}phenol, 2-[(1E)-2-(2-methyl-5-nitrophenyl)-2-azavinyl]phenol, (6E)-6-[(2-methyl-5-nitroanilino)methylidene]cyclohexa-2,4-dien-1-one
| Molecular Formula | C14H12N2O3 |
|---|---|
| Molecular Weight | 256.08 g/mol |
| LogP | 3.35942 |
| Topological Polar Surface Area | 75.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 256.08478 |
| Heavy Atoms | 19 |
| Complexity | 650.8894 |
Chemical Identifiers
| CAS Number | 67912-41-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)[N+](=O)[O-])N=CC2=CC=CC=C2O |
Product Overview
Alpha-(5-nitro-O-tolylimino)-O-cresol (CAS 67912-41-8), with molecular formula C14H12N2O3 and molecular weight 256.08 g/mol. IUPAC: 2-[(2-methyl-5-nitrophenyl)iminomethyl]phenol.
Chemical Property Profile of Alpha-(5-nitro-O-tolylimino)-O-cresol
Property Insights of Alpha-(5-nitro-O-tolylimino)-O-cresol
The XLogP value of 3.35942 indicates that Alpha-(5-nitro-O-tolylimino)-O-cresol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.73 Ų falls within the moderate polarity range, balancing permeability and solubility for Alpha-(5-nitro-O-tolylimino)-O-cresol. Following Lipinski's Rule of Five, Alpha-(5-nitro-O-tolylimino)-O-cresol has 1 hydrogen bond donor(s) and 4 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 Alpha-(5-nitro-O-tolylimino)-O-cresol?
The CAS number of Alpha-(5-nitro-O-tolylimino)-O-cresol is 67912-41-8.
What is the molecular formula of Alpha-(5-nitro-O-tolylimino)-O-cresol?
The molecular formula of Alpha-(5-nitro-O-tolylimino)-O-cresol is C14H12N2O3.
What is the molecular weight of Alpha-(5-nitro-O-tolylimino)-O-cresol?
The molecular weight of Alpha-(5-nitro-O-tolylimino)-O-cresol is 256.08 g/mol.
Where can I buy Alpha-(5-nitro-O-tolylimino)-O-cresol?
You can request a quote for Alpha-(5-nitro-O-tolylimino)-O-cresol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alpha-(5-nitro-O-tolylimino)-O-cresol?
Yes, KEHONG BIO provides custom synthesis services for Alpha-(5-nitro-O-tolylimino)-O-cresol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.