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Merck
CN

93332

2,4,6-Tris(heptafluoropropyl)-1,3,5-triazine

analytical standard, suitable for mass spectrometry (MS)

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About This Item

Empirical Formula (Hill Notation):
C12F21N3
CAS Number:
915-76-4
Molecular Weight:
585.11
EC Number:
213-023-8
UNSPSC Code:
41116107
PubChem Substance ID:
329770225
Beilstein/REAXYS Number:
381010
MDL number:
MFCD00042438

Key Documents

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InChI key

KXQUYHRRCVECPV-UHFFFAOYSA-N

InChI

1S/C12F21N3/c13-4(14,7(19,20)10(25,26)27)1-34-2(5(15,16)8(21,22)11(28,29)30)36-3(35-1)6(17,18)9(23,24)12(31,32)33

SMILES string

FC(F)(F)C(F)(F)C(F)(F)c1nc(nc(n1)C(F)(F)C(F)(F)C(F)(F)F)C(F)(F)C(F)(F)C(F)(F)F

grade

analytical standard

assay

≥98.0% (GC)

technique(s)

mass spectrometry (MS): suitable

refractive index

n20/D 1.311 (lit.)

bp

164-165 °C (lit.)

mp

~25 °C

density

1.716 g/mL at 25 °C (lit.)

application(s)

cleaning products
cosmetics
environmental
flavors and fragrances
food and beverages
personal care

format

neat

storage temp.

2-8°C

Other Notes

Chemical mass marker for negative ion chemical ionization mass spectrometry

pictograms

Exclamation mark
GHS07

signalword

Warning

hcodes

H332

Hazard Classifications

Acute Tox. 4 Inhalation

Storage Class

13 - Non Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Certificates of Analysis (COA)

Lot/Batch Number
BCBB2774V
BCBB2774

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D.V. Bowen et al.
Analytical Chemistry, 47, 2289-2289 (1975)

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