TRICHLOROACETONITRILE ,545-06-2 _Chemical Cloud Database

TRICHLOROACETONITRILE

Basic Information
Product Name：	TRICHLOROACETONITRILE
CAS：	545-06-2
English Synonyms：	CHLOROCYANOHYDRIN ; TRICHLOROMETHYLNITRILE ; TRITOX ; TRICHLOROACETONITRILE ; TRICHLOROMETHYL CYANIDE ; 2,2,2-TRICHLOROACETONITRILE ; CYANOTRICHLOROMETHANE
MDL Number.：	MFCD00001842
H bond acceptor：	1
H bond donor：	0
Smile：	ClC(C#N)(Cl)Cl
InChi：	InChI=1S/C2Cl3N/c3-2(4,5)1-6
InChiKey：	InChIKey=DRUIESSIVFYOMK-UHFFFAOYSA-N
Property
Melting Point：	-42℃
Boiling Point：	MP: -42 DEG C
Density：	1.44g/mLat25°C(lit.)
Physical Property：	FLASHPOINT: 195 DEG C FLASHPOINT: 383 DEG F REFRACTIVE INDEX: N20/D 1.441(LIT) VAPOR PRESSURE: 58 MMHG (20 DEG C)
Comments：	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 RIDADR: UN 3276 6.1/PG 3 RTECS: AM2450000 UNSPSC: 12352100 WGK: 3
Safety information
Symbol：	GHS06 GHS09
Signal word：	Danger
Hazard statements：	H301-H311-H331-H411
Precautionary statements：	P261-P273-P280-P301 + P310-P311
hazard symbol：	T,N
Risk Code：	R:23/24/25-51/53
Safe Code：	S:45-61
UN Code：	1610
WGK Germany：	3

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