4-(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE

CAS No.
1645-65-4
CCD No.
CCD00025896
Formula
C8 H4 F3 N S
MolWeight
203.187

Basic Information

Product Name: 4-(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE
CAS: 1645-65-4
English Synonyms: P-(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE ; 1-ISOTHIOCYANATO-4-(TRIFLUOROMETHYL)BENZENE ; ISOTHIOCYANIC ACID 4-(TRIFLUOROMETHYL)PHENYL ESTER ; 4-(TRIFLUOROMETHYL)PHENYL ISOTHIOCYANATE ; ALPHA,ALPHA,ALPHA-TRIFLUORO-P-TOLYL ISOTHIOCYANATE
MDL Number.: MFCD00039645
H bond acceptor: 1
H bond donor: 0
Smile: c1cc(ccc1C(F)(F)F)N=C=S
InChi: InChI=1S/C8H4F3NS/c9-8(10,11)6-1-3-7(4-2-6)12-5-13/h1-4H
InChiKey: InChIKey=DQEVDFQAYLIBRD-UHFFFAOYSA-N

Property

Melting Point: 39-43 DEG C(LIT)
Boiling Point: 81 DEG C/11 MMHG(LIT)
Physical Property: FLASHPOINT: 113 DEG C
FLASHPOINT: 235.4 DEG F
Comments: RIDADR: UN 3261 8/PG 2
UNSPSC: 12352100
WGK: 3

Safety information

Symbol: GHS05 GHS05 GHS08 GHS08
Signal word: Danger
Hazard statements: H314-H334
Precautionary statements: P261-P280-P305 + P351 + P338-P310
hazard symbol: C
Risk Code: R:34-42
Safe Code: S:26-36/37/39-45
WGK Germany: 3

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