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I12603

β-Ionone

Name: β-Ionone
Brand: ALDRICH

96%

Synonym(s):

beta-Ionone, 4-(2,6,6-Trimethyl-1-cyclohexenyl)-3-buten-2-one

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About This Item

Empirical Formula (Hill Notation):

C₁₃H₂₀O

CAS Number:

14901-07-6

Molecular Weight:

192.30

UNSPSC Code:

12352100

NACRES:

NA.22

PubChem Substance ID:

24895924

EC Number:

201-224-3

Beilstein/REAXYS Number:

1909544

MDL number:

MFCD00001549

Assay:

96%

Form:

liquid

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Properties

Quality Segment

100

assay

96%

form

liquid

refractive index

n20/D 1.52 (lit.)

bp

126-128 °C/12 mmHg (lit.)

density

0.945 g/mL at 25 °C (lit.)

functional group

ketone

SMILES string

CC(=O)\C=C\C1=C(C)CCCC1(C)C

InChI

1S/C13H20O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8H,5-6,9H2,1-4H3/b8-7+

InChI key

PSQYTAPXSHCGMF-BQYQJAHWSA-N

Description

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pictograms

GHS07,GHS09

signalword

Warning

hcodes

H315,H411

pcodes

P264 - P273 - P280 - P302 + P352 - P332 + P313 - P362 + P364

Hazard Classifications

Aquatic Chronic 2 - Skin Irrit. 2

Storage Class

10 - Combustible liquids

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter

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