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617113

Sigma-Aldrich

Benzyl butyl phthalate-3,4,5,6-d4

≥98 atom % D, ≥98%

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About This Item

Empirical Formula (Hill Notation):
C19D4H16O4
CAS Number:
93951-88-3
Molecular Weight:
316.38
MDL number:
MFCD00143880
UNSPSC Code:
12352202
PubChem Substance ID:
24874827

isotopic purity

≥98 atom % D

assay

≥98%

density

1.114 g/mL at 25 °C

mass shift

M+4

SMILES string

[2H]c1c([2H])c([2H])c(C(=O)OCc2ccccc2)c(c1[2H])C(=O)OCCCC

InChI

1S/C19H20O4/c1-2-3-13-22-18(20)16-11-7-8-12-17(16)19(21)23-14-15-9-5-4-6-10-15/h4-12H,2-3,13-14H2,1H3/i7D,8D,11D,12D

InChI key

IRIAEXORFWYRCZ-CXRURWBMSA-N

Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

pictograms

Health hazardEnvironment
GHS08,GHS09

signalword

Danger

Hazard Classifications

Aquatic Acute 1 - Aquatic Chronic 1 - Repr. 1B

Storage Class

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

wgk_germany

WGK 3

flash_point_f

235.4 °F - closed cup

flash_point_c

113 °C - closed cup

Certificates of Analysis (COA)

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