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W269905

Sigma-Aldrich

6-Methylcoumarin

≥99%, FCC, FG

Synonym(s):
6-methylchromen-2-one, Cocodescol, Pralina, Toncair, Toncarine
Empirical Formula (Hill Notation):
C10H8O2
CAS Number:
Molecular Weight:
160.17
FEMA Number:
2699
EC Number:
Council of Europe no.:
579
MDL number:
PubChem Substance ID:
Flavis number:
13.012
NACRES:
NA.21

biological source

synthetic

Quality Level

grade

FG
Halal
Kosher

Agency

meets purity specifications of JECFA

reg. compliance

EU Regulation 1334/2008 & 178/2002
FCC

Assay

≥99%

bp

303 °C/725 mmHg (lit.)

mp

73-76 °C (lit.)

application(s)

flavors and fragrances

Documentation

see Safety & Documentation for available documents

food allergen

no known allergens

Organoleptic

coconut; creamy; sage; vanilla

SMILES string

Cc1ccc2OC(=O)C=Cc2c1

InChI

1S/C10H8O2/c1-7-2-4-9-8(6-7)3-5-10(11)12-9/h2-6H,1H3

InChI key

FXFYOPQLGGEACP-UHFFFAOYSA-N

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W292206W326607W238104
6-Methylcoumarin ≥99%, FCC, FG

Sigma-Aldrich

W269905

6-Methylcoumarin

Propenyl guaethol ≥99%, FCC, FG

Sigma-Aldrich

W292206

Propenyl guaethol

Dihydrocoumarin ≥99%, FCC, FG

Sigma-Aldrich

W238104

Dihydrocoumarin

grade

FG, Halal, Kosher

grade

FG, Halal, Kosher

grade

FG, Halal, Kosher

grade

FG, Halal, Kosher

agency

meets purity specifications of JECFA

agency

meets purity specifications of JECFA

agency

meets purity specifications of JECFA

agency

meets purity specifications of JECFA

assay

≥99%

assay

≥99%

assay

≥98%

assay

≥99%

bp

303 °C/725 mmHg (lit.)

bp

-

bp

175 °C (lit.)

bp

272 °C (lit.)

mp

73-76 °C (lit.)

mp

86-88 °C (lit.)

mp

-

mp

24-25 °C (lit.)

Biochem/physiol Actions

Taste at 5 ppm

Pictograms

Exclamation markHealth hazard

Signal Word

Danger

Hazard Statements

Hazard Classifications

Acute Tox. 4 Oral - Resp. Sens. 1 - Skin Sens. 1

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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25G
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705578-5MG-PW

PL860-CGA/SHF-1EA

MMYOMAG-74K-13

1000309185

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W P Jordan
Contact dermatitis, 8(2), 109-116 (1982-03-01)
This report describes modifications in the techniques used for both the induction and elicitation of photoallergic contact dermatitis (PACD) in the guinea pig. These changes have improved the reliability of this animal as the model of choice for screening chemicals
Barry C Pemberton et al.
Chemical communications (Cambridge, England), 47(22), 6323-6325 (2011-05-05)
Guest induced shape change of the cucurbit[8]uril cavity is likely rate limiting in the supramolecular photocatalytic cycle for CB8 mediated photodimerization of 6-methylcoumarin.
Masatoshi Hoya et al.
Toxicology in vitro : an international journal published in association with BIBRA, 23(5), 911-918 (2009-04-11)
In this study, with the aim of developing a cell-based in vitro photosensitization assay, we examined whether changes of CD86 and CD54 expression on cells of a human monocytic cell line, THP-1, could be used to assess the photosensitizing potential
Feiying Zhang et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 71(2), 710-713 (2008-03-25)
The infrared absorption spectra of the carbonyl stretching vibrations of 6-methylcoumarin (6MC) have been investigated in CCl4/ROH mixtures (CCl4/C2H5OH, CCl4/n-C3H7OH, CCl4/i-C3H7OH, and CCl4/t-C5H11OH). Two types of carbonyl stretching vibration bands for 6MC are found with the change of the mole
Barry C Pemberton et al.
Chemical communications (Cambridge, England), 46(2), 225-227 (2009-12-22)
Cucurbit[8]uril (as low as 10 mol%) acts as a supramolecular catalytic nanoreaction vessel and facilitates the photodimerization of coumarins in water leading to syn dimers. Saturation kinetics shows a sigmoidal dependence with a turnover number of 3.4 min(-1) and a

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