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491098

Sigma-Aldrich

1,3-Dinitrobenzene-13C6

99 atom % 13C

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About This Item

Linear Formula:
13C6H4(NO2)2
CAS Number:
201595-60-0
Molecular Weight:
174.06
MDL number:
MFCD00142531
UNSPSC Code:
12352101
PubChem Substance ID:
24872633
NACRES:
NA.12

isotopic purity

99 atom % 13C

form

solid

bp

297 °C (lit.)

mp

88-90 °C (lit.)

density

1.416 g/mL at 25 °C

mass shift

M+6

SMILES string

[O-][N+](=O)[13c]1[13cH][13cH][13cH][13c]([13cH]1)[N+]([O-])=O

InChI

1S/C6H4N2O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H/i1+1,2+1,3+1,4+1,5+1,6+1

InChI key

WDCYWAQPCXBPJA-IDEBNGHGSA-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.

signalword

Danger

Hazard Classifications

Acute Tox. 1 Dermal - Acute Tox. 2 Inhalation - Acute Tox. 2 Oral - Aquatic Acute 1 - Aquatic Chronic 1 - STOT RE 2

Storage Class

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

wgk_germany

WGK 3

flash_point_f

302.0 °F - closed cup

flash_point_c

150.00 °C - closed cup

Certificates of Analysis (COA)

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