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Key Documents

W267215

Sigma-Aldrich

4-(4-Methoxyphenyl)-2-butanone

natural, ≥96%, FG

Synonym(s):

Anisylacetone

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About This Item

Linear Formula:
CH3OC6H4CH2CH2COCH3
CAS Number:
Molecular Weight:
178.23
FEMA Number:
2672
Beilstein:
1869592
MDL number:
UNSPSC Code:
12164502
Flavis number:
7.029
NACRES:
NA.21

biological source

botanical

grade

FG
Kosher
natural

reg. compliance

EU Regulation 1334/2008 & 178/2002
FDA 21 CFR 117

Assay

≥96%

refractive index

n20/D 1.519 (lit.)

bp

152-153 °C/15 mmHg (lit.)

mp

8 °C (lit.)

density

1.046 g/mL at 25 °C (lit.)

Documentation

see Safety & Documentation for available documents

food allergen

no known allergens

Organoleptic

fruity; floral; raspberry; sweet

SMILES string

COc1ccc(CCC(C)=O)cc1

InChI

1S/C11H14O2/c1-9(12)3-4-10-5-7-11(13-2)8-6-10/h5-8H,3-4H2,1-2H3

InChI key

PCBSXBYCASFXTM-UHFFFAOYSA-N

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Other Notes

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Storage Class Code

10 - Combustible liquids

WGK

WGK 2

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable


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