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ChemicalBook--->CAS DataBase List--->591-82-2

591-82-2

591-82-2 Structure

591-82-2 Structure
IdentificationMore
[Name]

ISOBUTYL ISOTHIOCYANATE
[CAS]

591-82-2
[Synonyms]

1-ISOTHIOCYANATO-2-METHYL-PROPANE
ISOBUTYL ISOTHIOCYANATE
ISOTHIOCYANIC ACID ISOBUTYL ESTER
1-isothiocyanato-2-methyl-propan
2-Methylpropyl isothiocyanate
2-methylpropylisothiocyanate
i-Butyl isothiocyanate
i-butylisothiocyanate
Propane, 1-isothiocyanato-2-methyl-
Isobutylisothiocyanate,97%
isobutyl mustard oil
Isothiocyanic acid isobutyl est
[EINECS(EC#)]

209-733-2
[Molecular Formula]

C5H9NS
[MDL Number]

MFCD00022062
[Molecular Weight]

115.2
[MOL File]

591-82-2.mol
Chemical PropertiesBack Directory
[Boiling point ]

160 °C
[density ]

0.94
[FEMA ]

4424 | ISOBUTYL ISOTHIOCYANATE
[refractive index ]

1.4980
[Fp ]

24°C
[form ]

clear liquid
[color ]

Colorless to Light yellow to Light orange
[Specific Gravity]

0.94
[Odor]

green
[Water Solubility ]

Hydrolyzes with water.
[Sensitive ]

Moisture Sensitive
[JECFA Number]

1886
[BRN ]

1740371
[LogP]

2.35
[CAS DataBase Reference]

591-82-2(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

F,C
[Risk Statements ]

R10:Flammable.
R23/24/25:Toxic by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S16:Keep away from sources of ignition-No smoking .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
[RIDADR ]

1992
[RTECS ]

NX8780100
[HazardClass ]

3
[PackingGroup ]

III
[HS Code ]

29309090
Hazard InformationBack Directory
[Chemical Properties]

Colorless to yellow liquid; green, pungent aroma.
[Occurrence]

Not reported found nature
[Uses]

It is isothiocyanate compound used for proteomics research.
[Aroma threshold values]

Very high strength odor; recommend smelling in a 0.01% solution or less.
Spectrum DetailBack Directory
[Spectrum Detail]

ISOBUTYL ISOTHIOCYANATE(591-82-2)MS
ISOBUTYL ISOTHIOCYANATE(591-82-2)1HNMR
ISOBUTYL ISOTHIOCYANATE(591-82-2)13CNMR
ISOBUTYL ISOTHIOCYANATE(591-82-2)IR1
ISOBUTYL ISOTHIOCYANATE(591-82-2)IR2
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Isobutyl isothiocyanate, 97%(591-82-2)
[Alfa Aesar]

Isobutyl isothiocyanate, 97%(591-82-2)
[TCI AMERICA]

Isobutyl Isothiocyanate,>97.0%(GC)(591-82-2)
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