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00468

β-Ionol

Name: β-Ionol
Brand: SIAL

technical, ≥90% (GC)

Synonym(s):

beta-Ionol, 4-(2,6,6-Trimethyl-1-cyclohexenyl)-3-buten-2-ol

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About This Item

Empirical Formula (Hill Notation):

C₁₃H₂₂O

CAS Number:

22029-76-1

Molecular Weight:

194.31

UNSPSC Code:

12352100

NACRES:

NA.22

PubChem Substance ID:

329747074

EC Number:

244-735-7

Beilstein/REAXYS Number:

1866761

MDL number:

MFCD00036597

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Properties

grade

technical

Quality Segment

100

assay

≥90% (GC)

form

liquid

refractive index

n20/D 1.501

bp

107 °C/3 mmHg (lit.)

density

0.928 g/mL at 20 °C (lit.)

SMILES string

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

InChI

1S/C13H22O/c1-10-6-5-9-13(3,4)12(10)8-7-11(2)14/h7-8,11,14H,5-6,9H2,1-4H3/b8-7+

InChI key

CNOPDZWOYFOHGN-BQYQJAHWSA-N

Description

Storage Class

10 - Combustible liquids

wgk

WGK 2

flash_point_f

199.4 °F - closed cup

flash_point_c

93 °C - closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter

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