A4571

3-(α-Acetonylbenzyl)-4-hydroxycoumarin sodium salt

≥98%

• Synonym(s): 4-Hydroxy-3-(3-oxo-1-phenylbutyl)coumarin
• Linear Formula: C₁₉H₁₅O₄Na
• CAS Number: 129-06-6
• Molecular Weight: 330.31
• NACRES: NA.22
• PubChem Substance ID: 57653851
• UNSPSC Code: 12352100
• MDL number: MFCD00083223
• Assay: ≥98%
• Form: powder

Properties

• Quality Segment: 200
• assay: ≥98%
• form: powder
• impurities: water, may contain traces, ~8% Isopropanol
• SMILES string: [Na].CC(=O)CC(c1ccccc1)C2=C(O)c3ccccc3OC2=O
• InChI: 1S/C19H16O4.Na/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22;/h2-10,15,21H,11H2,1H3;/q;+1/p-1
• InChI key: KYITYFHKDODNCQ-UHFFFAOYSA-M
• Gene Information: human ... VKORC1(79001)

Description

Safety Information

• pictograms: GHS06,GHS08
• signalword: Danger
• hcodes: H300,H360,H412
• pcodes: P202 - P264 - P270 - P273 - P280 - P301 + P310
• Hazard Classifications: Acute Tox. 2 Oral - Aquatic Chronic 3 - Repr. 1B
• Storage Class: 6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
• wgk: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable
• ppe: Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges