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Merck
CN

W295205

3-Propylidenephthalide

mixture of cis and trans isomers, ≥96%, FG

Synonym(s):

3-Propylidene-1(3H)-isobenzofuranone

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About This Item

Empirical Formula (Hill Notation):
C11H10O2
CAS Number:
Molecular Weight:
174.20
FEMA Number:
2952
Council of Europe no.:
494
UNSPSC Code:
12164502
PubChem Substance ID:
Flavis number:
10.005
EC Number:
241-402-8
NACRES:
NA.21
MDL number:
Organoleptic:
spicy; herbaceous; warm
Grade:
FG, Fragrance grade, Halal, Kosher
Biological source:
synthetic
Agency:
follows IFRA guidelines, meets purity specifications of JECFA
Food allergen:
no known allergens
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SMILES string

CC\C=C1/OC(=O)c2ccccc12

InChI key

NGSZDVVHIGAMOJ-YHYXMXQVSA-N

InChI

1S/C11H10O2/c1-2-5-10-8-6-3-4-7-9(8)11(12)13-10/h3-7H,2H2,1H3/b10-5-

biological source

synthetic

grade

FG, Fragrance grade, Halal, Kosher

agency

follows IFRA guidelines, meets purity specifications of JECFA

reg. compliance

EU Regulation 1223/2009, EU Regulation 1334/2008 & 178/2002, FDA 21 CFR 172.515

assay

≥96%

refractive index

n20/D 1.586 (lit.)

bp

170 °C/12 mmHg (lit.)

mp

5 °C (lit.)

density

1.122 g/mL at 25 °C (lit.)

application(s)

flavors and fragrances

documentation

see Safety & Documentation for available documents

food allergen

no known allergens

fragrance allergen

propylidene phthalide

organoleptic

spicy; herbaceous; warm

Quality Level

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pictograms

Exclamation mark

signalword

Warning

hcodes

Hazard Classifications

Acute Tox. 4 Oral - Skin Sens. 1B

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

235.4 °F - closed cup

flash_point_c

113 °C - closed cup


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