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495859

Sigma-Aldrich

Benzyl-2,3,4,5,6-d5 cyanide

≥98 atom % D, ≥98% (CP)

Synonym(s):

Benzene-d5-acetonitrile

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About This Item

Linear Formula:
C6D5CH2CN
CAS Number:
70026-36-7
Molecular Weight:
122.18
MDL number:
MFCD01317462
UNSPSC Code:
12352202
PubChem Substance ID:
24872998

isotopic purity

≥98 atom % D

Assay

≥98% (CP)

refractive index

n20/D 1.521 (lit.)

bp

233-234 °C (lit.)

mp

−24 °C (lit.)

density

1.059 g/mL at 25 °C (lit.)

mass shift

M+5

SMILES string

[2H]c1c([2H])c([2H])c(CC#N)c([2H])c1[2H]

InChI

1S/C8H7N/c9-7-6-8-4-2-1-3-5-8/h1-5H,6H2/i1D,2D,3D,4D,5D

InChI key

SUSQOBVLVYHIEX-RALIUCGRSA-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

Skull and crossbones
GHS06

Signal Word

Danger

Hazard Statements

H301 + H311,H330

Hazard Classifications

Acute Tox. 2 Inhalation - Acute Tox. 3 Dermal - Acute Tox. 3 Oral

Storage Class Code

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

WGK

WGK 2

Flash Point(F)

215.6 °F - closed cup

Flash Point(C)

102 °C - closed cup

Certificates of Analysis (COA)

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