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470384

Sigma-Aldrich

3-Methylbenzotrifluoride

98%

Synonym(s):

α,α,α-Trifluoro-m-xylene

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About This Item

Linear Formula:
CH3C6H4CF3
CAS Number:
401-79-6
Molecular Weight:
160.14
MDL number:
MFCD00190105
UNSPSC Code:
12352100
PubChem Substance ID:
24870657
NACRES:
NA.22

assay

98%

refractive index

n20/D 1.427 (lit.)

bp

130 °C (lit.)

density

1.148 g/mL at 25 °C (lit.)

SMILES string

Cc1cccc(c1)C(F)(F)F

InChI

1S/C8H7F3/c1-6-3-2-4-7(5-6)8(9,10)11/h2-5H,1H3

InChI key

VJYXZJGDFJJDGF-UHFFFAOYSA-N

pictograms

FlameExclamation mark
GHS02,GHS07

signalword

Warning

Hazard Classifications

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

target_organs

Respiratory system

Storage Class

3 - Flammable liquids

wgk_germany

WGK 3

flash_point_f

80.6 °F - closed cup

flash_point_c

27 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter

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Certificates of Analysis (COA)

Lot/Batch Number
05226JD
12806DD
U15628
15802JO
19824DO

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Improved synthesis of 1, 4, 5, 8, 9, 12-hexaazatriphenylene.
Rogers DZ.
The Journal of Organic Chemistry, 51(20), 3904-3905 (1986)

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