ESCULIN

Synonyms. Esculin; 6-(beta-D-Glucopyranosyloxy)-7-hydroxy-2H-1-benzopyran-2-one; Esculoside; Aesculin; (-)-Esculin; 6,7-Dihydroxycoumarin-6-O-glucoside; 6-(beta-D-Glucopyranosyloxy)-7-hydroxy-cumarin; 7-Hydroxy-6-cumarinyl-glucosid; 7-Hydroxy-6-glucosyloxy-2H-chromen; Aesculetin glukosid; Bicolorin; Crataegin; Enallachrome; Enallachrome; Escolin; Escosyl; Escolin; Escosyl; Esculetin 6-O-glucoside; Esculine; 7-Hydroxy-6-(((2S,3R,4S,5S,6R)-3,4,5-trihydroxy- 6-(hydroxymethyl)-2-tetrahydropyranyl)oxy)- 2-chromenone;

ESCULIN

Click for original image

 

PRODUCT IDENTIFICATION

CAS RN

531-75-9

EINECS RN

208-517-5

FORMULA

C15H16O9

MOLE WEIGHT

340.28

H.S CODE

2938.90.0000

SMILES

c12c(cc(O)c(c1)O[C@@H]1O[C@@H]([C@@H](O)[C@@H]([C@H]1O) O)CO) oc (=O)cc2

CLASSIFICATION

Phytochemical, Coumarin glycoside

EXTRA NOTES

Aesculin, also rendered Æsculin or Esculin, is a coumarin glucoside that naturally occurs in the horse chestnut (Aesculus hippocastanum), California Buckeye (Aesculus californica), Prickly Box (Bursaria spinosa) and in daphnin (the dark green resin of Daphne mezereum). It is also found in dandelion coffee.(wikipedia)
Other RN: 25360-17-2, 28633-38-7, 29008-74-0, 97882-87-6, 1078728-35-4

 

PHYSICAL AND CHEMICAL PROPERTIES

PHYSICAL STATE.

white crystalline powder

MELTING POINT

204 ~ 205 C

BOILING POINT

 

DENSITY

 

SOLUBILITY IN WATER

 

SOLVENT SOLUBILITY

 

VAPOR DENSITY

 

log P(octanol-water)

-1.71

VAPOR PRESSURE

 

AUTOIGNITION TEMP

 
pK

 

REFRACTIVE INDEX

 

FLASH POINT

 

 

STABILITY AND REACTIVITY
STABILITY Stable under normal conditions.

INCOMPATIBLE MATERIALS

Strong oxidizing agents

POLYMERIZATION

Has not been reported

NFPA RATINGS

Health: 1, Flammability: 0, Reactivity: 0

 

EXTERNAL LINKS & GENERAL DESCRIPTION

USA.gov - Esculin

Wikipedia Linking - Aesculin

Google Scholar Search - Esculin

U.S. National Library of Medicine - Esculin

PubChem Compound Summary - Esculin

Drug Bank -  Esculin

KEGG (Kyoto Encyclopedia of Genes and Genomes) -  Esculin

http://www.ebi.ac.uk/chebi/ -  Esculin

http://www.ncbi.nlm.nih.gov/ -  Esculin

EPA - Substance Registry Services - Esculin

 

SALES SPECIFICATION

APPEARANCE

white crystalline powder

ASSAY

98% min

MELTING POINT

204 ~ 205 C

LOSS ON DRYING

1% max

HEAVY METALS

10ppm max

 

TRANSPORT & REGULATORY INFORMATION

UN NO.

 

HAZARD CLASS

 

PACKING GROUP  

 

SAFETY INFORMATION

HAZARD OVERVIEW

GHS (Globally Harmonised System) Classification: Not a dangerous substance. Potential Health Effects: Eyes - May cause eye irritation. Skin - May be harmful if absorbed through skin May cause skin irritation. Inhalation - May be harmful if inhaled. May cause respiratory tract irritation. Ingestion - May be harmful if swallowed.

HAZARD CODES

 

RISK PHRASES

 

SAFETY PHRASES

 

 

PACKING

Preserved in light-resistant and well-closed bottles