Compound C20H21IN4O3

3-[3-[4-(4,5-dihydro-1H-imidazol-1-ium-2-ylamino)phenyl]-3-oxopropyl]-6-methyl-1,3-benzoxazol-2-one iodide

CAS: 100037-06-7

Molecular Formula	`C20H21IN4O3`
Molecular Weight	492.3 g/mol
Topological Polar Surface Area	87.6 A2
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	492.06583
Heavy Atoms	28
Complexity	600.0

Chemical Identifiers

CAS Number	100037-06-7
SMILES	`CC1=CC2=C(C=C1)N(C(=O)O2)CCC(=O)C3=CC=C(C=C3)NC4=NCC[NH2+]4.[I-]`
InChIKey	`QOXXFQDCNVISMD-UHFFFAOYSA-N`

📖 Product Overview

Compound C20H21IN4O3 (CAS: 100037-06-7) is a chemical compound with molecular formula C20H21IN4O3 and molecular weight 492.3 g/mol. Its IUPAC systematic name is 3-[3-[4-(4,5-dihydro-1H-imidazol-1-ium-2-ylamino)phenyl]-3-oxopropyl]-6-methyl-1,3-benzoxazol-2-one iodide. Topological Polar Surface Area 87.6 A2 Hydrogen Bond Donors 2 Hydrogen Bond Acceptors 5 Rotatable Bonds 6 Exact Mass 492.06583 Heavy Atoms 28 Complexity 600.0 InChI Key: QOXXFQDCNVISMD-UHFFFAOYSA-N. SMILES: CC1=CC2=C(C=C1)N(C(=O)O2)CCC(=O)C3=CC=C(C=C3)NC4=NCC[NH2+]4.[I-].

🧪

Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

View MSDS →

Frequently Asked Questions

What is the typical lead time for this product?

Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.

Can you provide samples for testing?

Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.

What documentation do you provide with the product?

We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.

Do you ship internationally?

Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

📚 Academic Support

Scientific research papers and technical documentation supporting this product for informed procurement decisions.

📖

Technical Blog Article

Multi-source research profile: chemical properties, regulatory status, and sourcing guide for Compound C20H21IN4O3.

Browse Technical Blog →

No research papers found for this product yet.

We continuously update our academic references. Check back soon!