2-(3,4,alpha-Trihydroxybenzyl)imidazoline
TL;DR: 2-(3,4,alpha-Trihydroxybenzyl)imidazoline (CAS 91297-44-8) is a chemical compound with molecular formula C10H12N2O3 and molecular weight 208.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4,5-dihydro-1H-imidazol-2-yl(hydroxy)methyl]benzene-1,2-diol
Also Known As: 2-Atbi, 2-(3,4,alpha-Trihydroxybenzyl)imidazoline, 1,2-Benzenediol,4-[ - hydroxymethyl]-, Phosphoric acid,bis(1-methylethyl) trimethylsilyl ester, 1,2-benzenediol,4-[(4,5-dihydro-1h-imidazol-2-yl)hydroxymethyl]-
| Molecular Formula | C10H12N2O3 |
|---|---|
| Molecular Weight | 208.08 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 85.1 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.0848 |
| Heavy Atoms | 15 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 91297-44-8 |
|---|---|
| SMILES | C1CN=C(N1)C(C2=CC(=C(C=C2)O)O)O |
| InChIKey | QXTDBFMUJTXKNQ-UHFFFAOYSA-N |
Product Overview
2-(3,4,alpha-Trihydroxybenzyl)imidazoline (CAS 91297-44-8), with molecular formula C10H12N2O3 and molecular weight 208.08 g/mol. IUPAC: 4-[4,5-dihydro-1H-imidazol-2-yl(hydroxy)methyl]benzene-1,2-diol.
Chemical Property Profile of 2-(3,4,alpha-Trihydroxybenzyl)imidazoline
Property Insights of 2-(3,4,alpha-Trihydroxybenzyl)imidazoline
The XLogP value of -0.4 indicates that 2-(3,4,alpha-Trihydroxybenzyl)imidazoline is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 85.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3,4,alpha-Trihydroxybenzyl)imidazoline. Following Lipinski's Rule of Five, 2-(3,4,alpha-Trihydroxybenzyl)imidazoline has 4 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 2-(3,4,alpha-Trihydroxybenzyl)imidazoline?
The CAS number of 2-(3,4,alpha-Trihydroxybenzyl)imidazoline is 91297-44-8.
What is the molecular formula of 2-(3,4,alpha-Trihydroxybenzyl)imidazoline?
The molecular formula of 2-(3,4,alpha-Trihydroxybenzyl)imidazoline is C10H12N2O3.
What is the molecular weight of 2-(3,4,alpha-Trihydroxybenzyl)imidazoline?
The molecular weight of 2-(3,4,alpha-Trihydroxybenzyl)imidazoline is 208.08 g/mol.
Where can I buy 2-(3,4,alpha-Trihydroxybenzyl)imidazoline?
You can request a quote for 2-(3,4,alpha-Trihydroxybenzyl)imidazoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4,alpha-Trihydroxybenzyl)imidazoline?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4,alpha-Trihydroxybenzyl)imidazoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.