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485764

Sigma-Aldrich

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

98 atom % D

Synonym(s):

α-Chlorotoluene-2,3,4,5,6-d5

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About This Item

Linear Formula:
C6D5CH2Cl
CAS Number:
68661-11-0
Molecular Weight:
131.61
MDL number:
MFCD00084127
UNSPSC Code:
12352116
PubChem Substance ID:
24872129
NACRES:
NA.12

isotopic purity

98 atom % D

Assay

99% (CP)

refractive index

n20/D 1.538 (lit.)

bp

177-181 °C (lit.)

mp

−43 °C (lit.)

density

1.144 g/mL at 25 °C

mass shift

M+5

SMILES string

[2H]c1c([2H])c([2H])c(CCl)c([2H])c1[2H]

InChI

1S/C7H7Cl/c8-6-7-4-2-1-3-5-7/h1-5H,6H2/i1D,2D,3D,4D,5D

InChI key

KCXMKQUNVWSEMD-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.

Signal Word

Danger

Hazard Classifications

Acute Tox. 3 Inhalation - Acute Tox. 4 Oral - Carc. 1B - Eye Dam. 1 - Flam. Liq. 3 - Skin Irrit. 2 - Skin Sens. 1 - STOT RE 2 Oral - STOT SE 3

Target Organs

Heart,forestomach, Respiratory system

Storage Class Code

3 - Flammable liquids

WGK

WGK 3

Flash Point(F)

140.0 °F - closed cup

Flash Point(C)

60.00 °C - closed cup

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Certificates of Analysis (COA)

Lot/Batch Number
MBBD1531
MBBC0298V
MBBB9385V
MBBB1801V
05862AE

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