Trichloroacetonitrile

ALDRICH/T53805 - 98%

Synonym: Trichlorocyanomethane; Tritox

CAS Number: 545-06-2
Empirical Formula (Hill Notation): C₂Cl₃N
Molecular Weight: 144.39
EC Number: 208-885-7
MDL Number: MFCD00001842
Linear Formula: Cl₃CCN
Product Type: Chemical

Catalog Number	PKG Qty.	Price	Quantity


45-T53805-5G	5 g	$67.10 1/EA		Add To Favorites
45-T53805-100G	100 g	$154.00 1/EA		Add To Favorites
45-T53805-500G	500 g	$187.00 1/EA		Add To Favorites

Properties
Descriptions
Safety Info.
Basic Data

assay	98%
bp	83-84 °C (lit.)
density	1.44 g/mL at 25 °C (lit.)
InChI	1S/C2Cl3N/c3-2(4,5)1-6
InChI key	DRUIESSIVFYOMK-UHFFFAOYSA-N
Quality Level	200
refractive index	n20/D 1.441 (lit.)
SMILES string	ClC(Cl)(Cl)C#N
vapor pressure	58 mmHg ( 20 °C)

Application:	Employed in a synthesis of trichloroacetimidates by DBU catalyzed addition of allylic alcohols and the subsequent study of the MOM catalyzed aza-Claisen rearrangement. Also used to prepare bistrichloroacetimidates from diols leading to dihyrooxazines via acid catalyzed cyclization.
Packaging:	10 kg in composite drum
Packaging:	5, 100, 500 g in glass bottle

Symbol	GHS06,GHS09
Signal word	Danger
Hazard statements	H301 + H311 + H331 - H411
Precautionary statements	P273 - P280 - P301 + P310 + P330 - P302 + P352 + P312 - P304 + P340 + P311
Hazard Codes	T,N
Risk Statements	23/24/25-36/38-51/53
Safety Statements	26-45-61
RIDADR	UN 3276 6.1 / PGIII
WGK Germany	WGK 3
Flash Point(F)	383.0 °F - closed cup
Flash Point(C)	195 °C - closed cup

Purity	98%
bp	83-84 °C (lit.)
Density	1.44 g/mL at 25 °C (lit.)
Refractive Index	n20/D 1.441 (lit.)
UNSPSC	12352117

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