3-(TRIFLUOROMETHYLTHIO)PHENYL ISOTHIOCYANATE

CAS No.
42729-26-0
CCD No.
CCD00331496
Formula
C8 H4 F3 N S2
MolWeight
235.253

Basic Information

Product Name: 3-(TRIFLUOROMETHYLTHIO)PHENYL ISOTHIOCYANATE
CAS: 42729-26-0
English Synonyms: 1-ISOTHIOCYANATO-3-[(TRIFLUOROMETHYL)SULFANYL]BENZENE ; 3-(TRIFLUOROMETHYLTHIO)PHENYL ISOTHIOCYANATE
MDL Number.: MFCD02683531
H bond acceptor: 1
H bond donor: 0
Smile: c1cc(cc(c1)SC(F)(F)F)N=C=S
InChi: InChI=1S/C8H4F3NS2/c9-8(10,11)14-7-3-1-2-6(4-7)12-5-13/h1-4H
InChiKey: InChIKey=ZVMPEUKZYDFXQN-UHFFFAOYSA-N

Property

Boiling Point: 230-244 DEG C(LIT)
Density: DENSITY: 1.37 G/ML AT 25 DEG C(LIT)
Physical Property: FLASHPOINT: 110 DEG C
FLASHPOINT: 230 DEG F
REFRACTIVE INDEX: N20/D 1.586(LIT)
Comments: RIDADR: UN 1760 8/PG 2
UNSPSC: 12352100
WGK: 3

Safety information

Symbol: GHS05 GHS05
Signal word: Danger
Hazard statements: H314
Precautionary statements: P280-P305 + P351 + P338-P310
hazard symbol: C
Risk Code: R:34
Safe Code: S:26-27-36/37/39-45
WGK Germany: 3

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