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2-[4-(2-Methylpropyl)phenyl]ethanol

Name: 2-[4-(2-Methylpropyl)phenyl]ethanol
Brand: SIAL

pharmaceutical impurity standard

Synonym(s):

Ibuprofen impurity Q (PhEur), 4-(2-Methylpropyl)benzeneethanol, 4-Isobutylphenylethanol, NSC 69112

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About This Item

Empirical Formula (Hill Notation):

C₁₂H₁₈O

CAS Number:

36039-35-7

Molecular Weight:

178.27

UNSPSC Code:

41116107

NACRES:

NA.24

PubChem Substance ID:

329759692

MDL number:

MFCD08275595

Beilstein/REAXYS Number:

1866730

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Properties

Quality Segment

100

API family

ibuprofen

assay

≥98.0% (HPLC)

shelf life

limited shelf life, expiry date on the label

impurities

≤1% water

application(s)

pharmaceutical (small molecule)

format

neat

SMILES string

OCCC1=CC=C(CC(C)C)C=C1

InChI

1S/C12H18O/c1-10(2)9-12-5-3-11(4-6-12)7-8-13/h3-6,10,13H,7-9H2,1-2H3

InChI key

CBKUDUSUCXBKIE-UHFFFAOYSA-N

Description

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Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

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