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586803

Sigma-Aldrich

1-(3-Aminophenyl)acetylene-1-13C

99 atom % 13C

Synonym(s):

3-(ethynyl-1)Benzenamine-13C

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About This Item

Empirical Formula (Hill Notation):
13CC7H7N
CAS Number:
286013-02-3
Molecular Weight:
118.14
MDL number:
MFCD00190268
UNSPSC Code:
12352005
PubChem Substance ID:
329758444

isotopic purity

99 atom % 13C

bp

78-80 °C/2 mmHg (lit.)

density

1.049 g/mL at 25 °C

mass shift

M+1

SMILES string

Nc1cccc(c1)[13C]#C

InChI

1S/C8H7N/c1-2-7-4-3-5-8(9)6-7/h1,3-6H,9H2/i2+1

InChI key

NNKQLUVBPJEUOR-VQEHIDDOSA-N

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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

FlameExclamation mark
GHS02,GHS07

Signal Word

Warning

Hazard Statements

H226,H315,H319,H335

Hazard Classifications

Eye Irrit. 2 - Flam. Liq. 3 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

3 - Flammable liquids

WGK

WGK 3

Flash Point(F)

138.2 °F - closed cup

Flash Point(C)

59 °C - closed cup

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’.

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