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Merck

44263

Diisopentyl phthalate

analytical standard

Synonym(s):

1,2-Benzenedicarboxylic acid 1,2-bis(3-methylbutyl) ester, Bis(3-methylbutyl) phthalate, Diisoamyl phthalate, NSC 17070, Phthalic acid diisopentyl ester

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About This Item

Empirical Formula (Hill Notation):
C18H26O4
CAS Number:
Molecular Weight:
306.40
UNSPSC Code:
41116107
NACRES:
NA.24
PubChem Substance ID:
MDL number:
Beilstein/REAXYS Number:
2134957
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grade

analytical standard

Quality Segment

assay

≥95.0% (GC)

shelf life

limited shelf life, expiry date on the label

refractive index

n20/D 1.485-1.489

application(s)

environmental

format

neat

storage temp.

2-8°C

SMILES string

O=C(OCCC(C)C)C1=CC=CC=C1C(OCCC(C)C)=O

InChI

1S/C18H26O4/c1-13(2)9-11-21-17(19)15-7-5-6-8-16(15)18(20)22-12-10-14(3)4/h5-8,13-14H,9-12H2,1-4H3

InChI key

JANBFCARANRIKJ-UHFFFAOYSA-N

General description

This compound is listed in the SVHC (Substances of very high concern) candidate list of ECHA (European Chemicals Agency)

Application

Diisopentyl phthalate may be used as a reference standard in the quantification the analyte in polyvinyl chloride (PVC) medical devices by gas chromatography coupled with mass spectrometry (GC-MS).

Other Notes

Find a digital Reference Material for this product available on our online platform ChemisTwin® for NMR. You can use this digital equivalent on ChemisTwin® for your sample identity confirmation and compound quantification (with digital external standard). An NMR spectrum of this substance can be viewed and an online comparison against your sample can be performed with a few mouseclicks. Learn more here and start your free trial.


signalword

Danger

Hazard Classifications

Aquatic Acute 1 - Repr. 1B - Skin Sens. 1

flash_point_f

330.8 °F

flash_point_c

166 °C

Storage Class

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects



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