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2-Isocyanato-1-Methyl-3-(2-Methyl-2-Propanyl)Benzene
[CAS# 13680-30-3]

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Identification
Name 2-Isocyanato-1-Methyl-3-(2-Methyl-2-Propanyl)Benzene
Synonyms 1-tert-butyl-2-isocyanato-3-methyl-benzene; 2-TERT-BUTYL-6-METHYLPHENYL ISOCYANATE; 2-tert-butyl-6-methylphenylisocyanate
Molecular Structure CAS#: 13680-30-3, 2-Isocyanato-1-Methyl-3-(2-Methyl-2-Propanyl)Benzene
Molecular Formula C12H15NO
Molecular Weight 189.25
CAS Registry Number 13680-30-3
SMILES CC1=C(C(=CC=C1)C(C)(C)C)N=C=O
InChI 1S/C12H15NO/c1-9-6-5-7-10(12(2,3)4)11(9)13-8-14/h5-7H,1-4H3
InChIKey VCHAHDOWZAYVEM-UHFFFAOYSA-N
Properties
Density 0.9±0.1g/cm3 (Cal.)
Melting point 36-38°C (Expl.)
Boiling point 257.0±19.0°C at 760 mmHg (Cal.)
242°C (Expl.)
Flash point 92.7±24.1°C (Cal.)
108°C (Expl.)
Refractive index 1.498 (Cal.)
Safety Data
Safety Code S22;S26;S36/37;S45  Details
Risk Code R20/22;R36/37/38;R42  Details
Hazard Symbol symbol  X  Details
Transport Information UN2811
Safety Description HARMFUL / IRRITANT
SDS Available
Market Analysis Reports
List of Reports Available for 2-Isocyanato-1-Methyl-3-(2-Methyl-2-Propanyl)Benzene
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