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604402

Sigma-Aldrich

Phenylacetylene-1,2-13C2

99 atom % 13C

Synonym(s):

Ethynyl-13C2-benzene

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About This Item

Linear Formula:
C6H513C≡13CH
Molecular Weight:
104.12
MDL number:
MFCD01075509
UNSPSC Code:
12352003
PubChem Substance ID:
329758985

isotopic purity

99 atom % 13C

assay

99% (CP)

bp

142-144 °C (lit.)

density

0.948 g/mL at 25 °C

mass shift

M+2

SMILES string

[13CH]#[13C]c1ccccc1

InChI

1S/C8H6/c1-2-8-6-4-3-5-7-8/h1,3-7H/i1+1,2+1

InChI key

UEXCJVNBTNXOEH-ZDOIIHCHSA-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

FlameCorrosion
GHS02,GHS05

signalword

Danger

Hazard Classifications

Aquatic Chronic 3 - Eye Dam. 1 - Flam. Liq. 3 - Skin Corr. 1B

Storage Class

3 - Flammable liquids

wgk_germany

WGK 3

flash_point_f

80.6 °F - closed cup

flash_point_c

27.00 °C - closed cup

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Certificates of Analysis (COA)

Lot/Batch Number
MBBB2831V
CC0835
CL1942

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