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3,4-(Methylenedioxy)Benzyl Isothiocyanate
[CAS# 4430-47-1]

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Identification
Name 3,4-(Methylenedioxy)Benzyl Isothiocyanate
Synonyms Zinc02168513; Bb_Sc-1810
Molecular Structure CAS#: 4430-47-1, 3,4-(Methylenedioxy)Benzyl Isothiocyanate
Molecular Formula C9H7NO2S
Molecular Weight 193.22
CAS Registry Number 4430-47-1
SMILES S=C=NCC1=CC=C2C(=C1)OCO2
InChI 1S/C9H7NO2S/c13-5-10-4-7-1-2-8-9(3-7)12-6-11-8/h1-3H,4,6H2
InChIKey PUJWRDBPAFJUJW-UHFFFAOYSA-N
Properties
Density 1.32 (Expl.)
1.3±0.1g/cm3 (Cal.)
Boiling point 320.4±11.0°C at 760 mmHg (Cal.)
139-140°C (Expl.)
Flash point 147.6±19.3°C (Cal.)
Refractive index 1.615 (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
HARMFUL / IRRITANT
SDS Available
Market Analysis Reports
List of Reports Available for 3,4-(Methylenedioxy)Benzyl Isothiocyanate
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