ChemicalBook--->CAS DataBase List--->113504-93-1

113504-93-1

113504-93-1 Structure

113504-93-1 Structure
IdentificationMore
[Name]

3,4-METHYLENEDIOXYPHENYL ISOTHIOCYANATE
[CAS]

113504-93-1
[Synonyms]

1,3-BENZODIOXOL-5-YL ISOTHIOCYANATE
3,4-METHYLENEDIOXYPHENYL ISOTHIOCYANATE
5-ISOTHIOCYANATO-BENZO[1,3]DIOXOLE
5-Isothiocyanato-1,3-benzodioxole
1,3-Benzodioxole,5-isothiocyanato-(9CI)
3,4-METHYLENEDIOXYPHENYL ISOTHIOCYANATE 98%
[Molecular Formula]

C8H5NO2S
[MDL Number]

MFCD00066321
[Molecular Weight]

179.2
[MOL File]

113504-93-1.mol
Chemical PropertiesBack Directory
[Melting point ]

57 °C
[Boiling point ]

137 °C
[density ]

1.37±0.1 g/cm3(Predicted)
[storage temp. ]

Keep cold
[form ]

solid
[color ]

Dark brown
[Sensitive ]

Lachrymatory
[CAS DataBase Reference]

113504-93-1(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

T,Xi
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

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 ]

2811
[Hazard Note ]

Toxic/Lachrymatory/Keep cold
[HazardClass ]

IRRITANT
[HS Code ]

2932990090
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Ethanol-->Nitric acid-->Chloroform-->Sodium bicarbonate-->Palladium hydroxide-->Thiophosgene-->1,3-Benzodioxole
Hazard InformationBack Directory
[Uses]

5-Isothiocyanato-1,3-benzodioxole is a useful research chemical used in the preparation of structure-human glutaminyl cyclase inhibiting activity relationships of imidazolylalkylamine compounds.
Spectrum DetailBack Directory
[Spectrum Detail]

3,4-METHYLENEDIOXYPHENYL ISOTHIOCYANATE(113504-93-1)FT-IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

1,3-Benzodioxol-5-yl isothiocyanate, 97%(113504-93-1)
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