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Merck

393983

Benzophenone-2,3,4,5,6-d5

98 atom % D

Synonym(s):

2,3,4,5,6-Pentadeuterobenzophenone

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About This Item

Linear Formula:
C6H5COC6D5
CAS Number:
2694-78-2
Molecular Weight:
187.25
UNSPSC Code:
12352202
PubChem Substance ID:
24864557
MDL number:
MFCD00084123
Isotopic purity:
98 atom % D
Mass shift:
M+5
Form:
solid

Key Documents

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Product Name

Benzophenone-2,3,4,5,6-d5, 98 atom % D

InChI

1S/C13H10O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H/i1D,3D,4D,7D,8D

SMILES string

[2H]c1c([2H])c([2H])c(c([2H])c1[2H])C(=O)c2ccccc2

InChI key

RWCCWEUUXYIKHB-DYVTXVBDSA-N

isotopic purity

98 atom % D

form

solid

bp

305 °C (lit.)

mp

47-51 °C (lit.)

mass shift

M+5

Quality Level

200

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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 hazard
GHS08

signalword

Danger

Hazard Classifications

Aquatic Chronic 3 - Carc. 1B - STOT RE 2 Oral

target_organs

Liver,Kidney

Storage Class

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

wgk

WGK 1

flash_point_f

280.4 °F - closed cup

flash_point_c

138 °C - closed cup

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Certificates of Analysis (COA)

Lot/Batch Number
MBBD7729
07628EZ
21109DO
02529EO
TP0335

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Kristina Kotnik et al.
Chemosphere, 147, 114-123 (2016-01-15)
This study investigates the environmental fate of eight benzophenone derivatives (the pharmaceutical ketoprofen, its phototransformation products 3-ethylbenzophenone and 3-acetylbenzophenone, and five benzophenone-type UV filters) by evaluating their photolytic behaviour. In addition, the genotoxicity of these compounds and the produced photodegradation

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