Coumarin 314

ethyl 4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraene-5-carboxylate

CAS: 55804-66-5

Molecular Formula	`C18H19NO4`
Molecular Weight	313.3 g/mol
LogP	3.2
Topological Polar Surface Area	55.8 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	3
Exact Mass	313.1314
Heavy Atoms	23
Complexity	543.0

Chemical Identifiers

CAS Number	55804-66-5
SMILES	`CCOC(=O)C1=CC2=CC3=C4C(=C2OC1=O)CCCN4CCC3`
InChIKey	`VMJKUPWQKZFFCX-UHFFFAOYSA-N`

📖 Product Overview

Coumarin 314 (CAS: 55804-66-5) is a chemical compound with molecular formula C18H19NO4 and molecular weight 313.3 g/mol. Its IUPAC systematic name is ethyl 4-oxo-3-oxa-13-azatetracyclo[7.7.1.02,7.013,17]heptadeca-1,5,7,9(17)-tetraene-5-carboxylate. LogP 3.2 Topological Polar Surface Area 55.8 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 5 Rotatable Bonds 3 Exact Mass 313.1314 Heavy Atoms 23 Complexity 543.0 InChI Key: VMJKUPWQKZFFCX-UHFFFAOYSA-N. SMILES: CCOC(=O)C1=CC2=CC3=C4C(=C2OC1=O)CCCN4CCC3.

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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.

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

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

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