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19241-16-8

19241-16-8 Structure

19241-16-8 Structure
IdentificationMore
[Name]

2,6-DIMETHYLPHENYL ISOTHIOCYANATE
[CAS]

19241-16-8
[Synonyms]

2,6-DIMETHYLPHENYL ISOTHIOCYANATE
2,6-Dimethylphenyl-1-isothiocyanate
2,6-Xylyl isothiocyanate
2-Isothiocyanato-1,3-dimethylbenzene
Benzene, 2-isothiocyanato-1,3-dimethyl-
Isothiocyanic acid, 2,6-xylyl ester
[EINECS(EC#)]

242-906-0
[Molecular Formula]

C9H9NS
[MDL Number]

MFCD00038715
[Molecular Weight]

163.24
[MOL File]

19241-16-8.mol
Chemical PropertiesBack Directory
[Appearance]

clear light yellow liquid
[Boiling point ]

247 °C (lit.)
[density ]

1.085 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.627(lit.)
[Fp ]

>230 °F
[storage temp. ]

2-8°C
[form ]

neat
[Specific Gravity]

1.085
[Water Solubility ]

Hydrolyzes in water.
[Sensitive ]

Moisture Sensitive
[BRN ]

637195
[InChI]

InChI=1S/C9H9NS/c1-7-4-3-5-8(2)9(7)10-6-11/h3-5H,1-2H3
[InChIKey]

UULUECCNPPJFBU-UHFFFAOYSA-N
[SMILES]

C1(C)=CC=CC(C)=C1N=C=S
[CAS DataBase Reference]

19241-16-8(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xn,C,Xi
[Risk Statements ]

R22:Harmful if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin .
R43:May cause sensitization by skin contact.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[RIDADR ]

2810
[WGK Germany ]

3
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29309090
[Storage Class]

10 - Combustible liquids
[Hazard Classifications]

Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
Skin Sens. 1
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

clear light yellow liquid
[Uses]

2,6-Dimethylphenyl isocyanate has been used in the preparation of derivatized β-cyclodextrins, used as chiral stationary phase in normal-phase liquid chromatography, tris( 2,6-dimethylphenylimido)methylrhenium (VII), 1-(2-isopropylphenyl)-3-(2,6-dimethylphenyl)urea.
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

2,6-Dimethylphenyl isothiocyanate, 98%(19241-16-8)
[Alfa Aesar]

2,6-Dimethylphenyl isothiocyanate, 98%(19241-16-8)
[Sigma Aldrich]

19241-16-8(sigmaaldrich)
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