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491527

Sigma-Aldrich

4′-Chloroacetophenone-2′,3′,5′,6′-d4

98 atom % D

Synonym(s):

1-(4-Chloro-2,3,5,6-tetradeuteriophenyl)ethanone

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About This Item

Linear Formula:
ClC6D4COCH3
CAS Number:
284474-50-6
Molecular Weight:
158.62
MDL number:
MFCD00084129
UNSPSC Code:
12352202
PubChem Substance ID:
24872659

isotopic purity

98 atom % D

refractive index

n20/D 1.5549 (lit.)

bp

232 °C (lit.)

mp

14-18 °C (lit.)

density

1.192 g/mL at 25 °C

mass shift

M+4

SMILES string

[2H]c1c([2H])c(c([2H])c([2H])c1Cl)C(C)=O

InChI

1S/C8H7ClO/c1-6(10)7-2-4-8(9)5-3-7/h2-5H,1H3/i2D,3D,4D,5D

InChI key

BUZYGTVTZYSBCU-QFFDRWTDSA-N

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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

Skull and crossbonesCorrosion
GHS06,GHS05

Signal Word

Danger

Hazard Statements

H302,H315,H318,H330,H335

Hazard Classifications

Acute Tox. 2 Inhalation - Acute Tox. 4 Oral - Eye Dam. 1 - Skin Irrit. 2 - STOT SE 3

Storage Class Code

6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials

WGK

WGK 1

Flash Point(F)

194.0 °F - closed cup

Flash Point(C)

90.00 °C - closed cup

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Certificates of Analysis (COA)

Lot/Batch Number
14279HS
OC0411

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