Skip to Content
Merck
All Photos(1)

Documents

604399

Sigma-Aldrich

Phenylacetylene-2-13C

99 atom % 13C

Synonym(s):

13C Labeled phenylacetylene, Ethynyl-2-13C-benzene

Sign Into View Organizational & Contract Pricing
All Photos(1)

About This Item

Linear Formula:
C6H5C≡13CH
CAS Number:
54522-92-8
Molecular Weight:
103.13
MDL number:
MFCD00190345
UNSPSC Code:
12352101
PubChem Substance ID:
329758984
NACRES:
NA.12

isotopic purity

99 atom % 13C

Assay

99% (CP)

bp

142-144 °C (lit.)

density

0.939 g/mL at 25 °C

mass shift

M+1

SMILES string

[13CH]#Cc1ccccc1

InChI

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

InChI key

UEXCJVNBTNXOEH-OUBTZVSYSA-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. 4 Oral - Asp. Tox. 1 - Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

3 - Flammable liquids

WGK

WGK 1

Flash Point(F)

80.6 °F

Flash Point(C)

27 °C

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

Already Own This Product?

Find documentation for the products that you have recently purchased in the Document Library.

Visit the Document Library

Customers Also Viewed

Slide 1 of 2

1 of 2

4-Ethynylanisole 97%

Sigma-Aldrich

206490

4-Ethynylanisole

Ethynyltrimethylsilane 98%

Sigma-Aldrich

218170

Ethynyltrimethylsilane

Our team of scientists has experience in all areas of research including Life Science, Material Science, Chemical Synthesis, Chromatography, Analytical and many others.

Contact Technical Service