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2-Isopropylphenyl Isothiocyanate
[CAS# 36176-31-5]

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Identification
Name 2-Isopropylphenyl Isothiocyanate
Synonyms 1-Isopropyl-2-Isothiocyanato-Benzene; 1-Isopropyl-2-Isothiocyanatobenzene; 1-Isothiocyanato-2-Propan-2-Yl-Benzene
Molecular Structure CAS#: 36176-31-5, 2-Isopropylphenyl Isothiocyanate
Molecular Formula C10H11NS
Molecular Weight 177.26
CAS Registry Number 36176-31-5
SMILES S=C=NC1=CC=CC=C1C(C)C
InChI 1S/C10H11NS/c1-8(2)9-5-3-4-6-10(9)11-7-12/h3-6,8H,1-2H3
InChIKey QQOOMDSEMQHMIR-UHFFFAOYSA-N
Properties
Density 1.0±0.1g/cm3 (Cal.)
1.05 (Expl.)
Boiling point 131-132°C (Expl.)
268.0±19.0°C at 760 mmHg (Cal.)
Flash point 117.3±29.3°C (Cal.)
Refractive index 1.605 (Expl.)
Safety Data
Safety Code S26;S36/37/39;S45  Details
Risk Code R20/21/22;R34  Details
Hazard Symbol symbol  symbol  X;C  Details
Transport Information UN2922
Safety Description DANGER: CORROSIVE, POISON, burns skin and eyes
DANGER: CORROSIVE, POISON, irritates skin and eyes
SDS Available
Market Analysis Reports
List of Reports Available for 2-Isopropylphenyl Isothiocyanate
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