5-((2-Hydroxybenzyl)amino)-2-methylbenzenecarbonitrile
TL;DR: 5-((2-Hydroxybenzyl)amino)-2-methylbenzenecarbonitrile (CAS 297149-83-8) is a chemical compound with molecular formula C15H14N2O and molecular weight 238.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2-hydroxyphenyl)methylamino]-2-methylbenzonitrile
Also Known As: 5-[(2-hydroxybenzyl)amino]-2-methylbenzenecarbonitrile, 5-{[(2-hydroxyphenyl)methyl]amino}-2-methylbenzonitrile, 5-((2-HYDROXYBENZYL)AMINO)-2-METHYLBENZENECARBONITRILE, 5-[(2-hydroxyphenyl)methylamino]-2-methylbenzonitrile, 5-[(2-hydroxybenzyl)amino]-2-methylbenzonitrile
| Molecular Formula | C15H14N2O |
|---|---|
| Molecular Weight | 238.11 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 56.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 238.11061 |
| Heavy Atoms | 18 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 297149-83-8 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NCC2=CC=CC=C2O)C#N |
| InChIKey | KRBCZOMSLONOPR-UHFFFAOYSA-N |
Product Overview
5-((2-Hydroxybenzyl)amino)-2-methylbenzenecarbonitrile (CAS 297149-83-8), with molecular formula C15H14N2O and molecular weight 238.11 g/mol. IUPAC: 5-[(2-hydroxyphenyl)methylamino]-2-methylbenzonitrile.
Chemical Property Profile of 5-((2-Hydroxybenzyl)amino)-2-methylbenzenecarbonitrile
Property Insights of 5-((2-Hydroxybenzyl)amino)-2-methylbenzenecarbonitrile
The XLogP value of 3.1 indicates that 5-((2-Hydroxybenzyl)amino)-2-methylbenzenecarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.1 Ų, 5-((2-Hydroxybenzyl)amino)-2-methylbenzenecarbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-((2-Hydroxybenzyl)amino)-2-methylbenzenecarbonitrile has 2 hydrogen bond donor(s) and 3 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 5-((2-Hydroxybenzyl)amino)-2-methylbenzenecarbonitrile?
The CAS number of 5-((2-Hydroxybenzyl)amino)-2-methylbenzenecarbonitrile is 297149-83-8.
What is the molecular formula of 5-((2-Hydroxybenzyl)amino)-2-methylbenzenecarbonitrile?
The molecular formula of 5-((2-Hydroxybenzyl)amino)-2-methylbenzenecarbonitrile is C15H14N2O.
What is the molecular weight of 5-((2-Hydroxybenzyl)amino)-2-methylbenzenecarbonitrile?
The molecular weight of 5-((2-Hydroxybenzyl)amino)-2-methylbenzenecarbonitrile is 238.11 g/mol.
Where can I buy 5-((2-Hydroxybenzyl)amino)-2-methylbenzenecarbonitrile?
You can request a quote for 5-((2-Hydroxybenzyl)amino)-2-methylbenzenecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-((2-Hydroxybenzyl)amino)-2-methylbenzenecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 5-((2-Hydroxybenzyl)amino)-2-methylbenzenecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.