o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI-
TL;DR: o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI- (CAS 4081-35-0) is a chemical compound with molecular formula C20H24N2O2 and molecular weight 324.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[6-[(2-hydroxyphenyl)methylimino]hexylideneamino]methyl]phenol
Also Known As: Disalicylalhexamethylenediamine, N,N'-Disalicylidene-1,6-hexanediamine, alpha,alpha'-(Hexamethylenedinitrilo)di-o-cresol, o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI-, 2,2'-(1,6-Hexanediylbis(nitrilomethylidyne))bisphenol
| Molecular Formula | C20H24N2O2 |
|---|---|
| Molecular Weight | 324.18 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 65.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 324.18378 |
| Heavy Atoms | 24 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 4081-35-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CN=CCCCCC=NCC2=CC=CC=C2O)O |
| InChIKey | CRGRLOKWPRTHCA-UHFFFAOYSA-N |
Product Overview
o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI- (CAS 4081-35-0), with molecular formula C20H24N2O2 and molecular weight 324.18 g/mol. IUPAC: 2-[[6-[(2-hydroxyphenyl)methylimino]hexylideneamino]methyl]phenol.
Chemical Property Profile of o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI-
Property Insights of o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI-. The TPSA of 65.2 Ų falls within the moderate polarity range, balancing permeability and solubility for o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI-. Following Lipinski's Rule of Five, o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI- has 2 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 o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI-?
The CAS number of o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI- is 4081-35-0.
What is the molecular formula of o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI-?
The molecular formula of o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI- is C20H24N2O2.
What is the molecular weight of o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI-?
The molecular weight of o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI- is 324.18 g/mol.
Where can I buy o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI-?
You can request a quote for o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI-?
Yes, KEHONG BIO provides custom synthesis services for o-CRESOL, alpha,alpha'-(HEXAMETHYLENEDINITRILO)DI- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.