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586765

Sigma-Aldrich

Aniline-4-13C

99 atom % 13C

Synonym(s):

Benzenamine-4-13C

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About This Item

Linear Formula:
13CC5H4NH2
CAS Number:
55147-71-2
Molecular Weight:
93.11
MDL number:
MFCD01075584
UNSPSC Code:
12352005
PubChem Substance ID:
329758443

isotopic purity

99 atom % 13C

bp

184 °C (lit.)

mp

-6 °C (lit.)

density

1.033 g/mL at 25 °C

mass shift

M+1

storage temp.

2-8°C

SMILES string

Nc1cc[13cH]cc1

InChI

1S/C6H7N/c7-6-4-2-1-3-5-6/h1-5H,7H2/i1+1

InChI key

PAYRUJLWNCNPSJ-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. 3 Dermal - Acute Tox. 3 Inhalation - Acute Tox. 3 Oral - Aquatic Acute 1 - Aquatic Chronic 1 - Carc. 2 - Eye Dam. 1 - Muta. 2 - Resp. Sens. 1

Storage Class Code

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

WGK

WGK 3

Flash Point(F)

168.8 °F - closed cup

Flash Point(C)

76 °C - closed cup

Certificates of Analysis (COA)

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Ronald Besandre et al.
Organic letters, 15(7), 1666-1669 (2013-03-15)
N-substituted indoles are synthesized from primary amines through a tandem reaction sequence. Initial condensation of the amine with an α-(o-haloaryl)ketone or aldehyde is followed by intramolecular aryl amination catalyzed by CuI. A variety of anilines and alkyl amines, including those
Timo Stahl et al.
Journal of the American Chemical Society, 135(4), 1248-1251 (2013-01-15)
Heterolytic splitting of the Si-H bond mediated by a Ru-S bond forms a sulfur-stabilized silicon cation that is sufficiently electrophilic to abstract fluoride from CF(3) groups attached to selected anilines. The ability of the Ru-H complex, generated in the cooperative
A Subashini et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 104, 403-408 (2013-01-01)
One of the Schiff base 4-bromo-4'dimethylamino benzylideneaniline (BDMABA) compounds was synthesized and single crystal of the material was grown by solvent evaporation method at room temperature. Molecular structure of BDMABA was confirmed by (1)H nuclear magnetic resonance and the presence
Wen Chen et al.
Journal of the American Chemical Society, 135(11), 4438-4449 (2013-03-02)
A series of linear and cyclic, sequence controlled, DNA-conjoined copolymers of aniline (ANi) and 2,5-bis(2-thienyl)pyrrole (SNS) were synthesized. In one approach, linear copolymers were prepared from complementary DNA oligomers containing covalently attached SNS and ANi monomers. Hybridization of the oligomers
Roman Spesyvtsev et al.
Faraday discussions, 157, 165-179 (2012-12-13)
Femtosecond time-resolved photoelectron imaging is employed to investigate ultrafast electronic relaxation in aniline, a prototypical aromatic amine. The molecule is excited at wavelengths between 269 and 238 nm. We observe that the S2(pi3s/pi sigma*) state is populated directly during the
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