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4-Methoxybenzyl isothiocyanate, 95%

Catalog No. AC413810050
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Quantity:
5 g
Packaging:
Glass bottle
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Catalog No. Quantity Packaging
AC413810050 5 g Glass bottle
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Catalog No. AC413810050 Supplier Thermo Scientific Chemicals Supplier No. 413810050
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Description

CAS: 3694-57-3 | C9H9NOS | 179.24 g/mol

This Thermo Scientific Chemicals brand product was originally part of the Acros Organics product portfolio. Some documentation and label information may refer to the legacy brand. The original Acros Organics product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Chemical Identifiers

CAS 3694-57-3
Molecular Formula C9H9NOS
Molecular Weight (g/mol) 179.24
MDL Number MFCD00041117
InChI Key IMFQYAJJXFXVMM-UHFFFAOYSA-N
Synonym 4-methoxybenzyl isothiocyanate, 1-isothiocyanatomethyl-4-methoxybenzene, 4-methoxybenzylisothiocyanate, benzene, 1-isothiocyanatomethyl-4-methoxy, p-methoxybenzyl isothiocyanate, 1-isothiocyanatomethyl-4-methoxy-benzene, chembl81201, 4-methoxybenzyl isothiocyanate 5gr, acmc-1cq6l
PubChem CID 123197
IUPAC Name 1-(isothiocyanatomethyl)-4-methoxybenzene
SMILES COC1=CC=C(C=C1)CN=C=S

Specifications

CAS Min % 95.0
Color White
Density 1.0872g/mL
Boiling Point 170.0°C to 175.0°C (16.0 mmHg)
Infrared Spectrum Authentic
Assay Percent Range 94% min. (GC)
Packaging Glass bottle
Refractive Index 1.5910 to 1.5980
Quantity 5 g
Beilstein 13, IV, 1747
Specific Gravity 1.0872
Formula Weight 179.24
Percent Purity 95%
Physical Form Crystalline Powder and/or Chunks
Chemical Name or Material 4-Methoxybenzyl isothiocyanate, 95%
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Safety and Handling

Hazard Category GHS Signal Word: Warning
Hazard Statement GHS H Statement
Harmful in contact with skin.
Causes serious eye irritation.
Harmful if swallowed.
Causes skin irritation.
Harmful if inhaled.
May cause respiratory irritation.
Precautionary Statement GHS P Statement
Wear protective gloves/protective clothing/eye protection/face protection.
IF ON SKIN: Wash with plenty of soap and water.
IF SWALLOWED: rinse mouth.
Do NOT induce vomiting.
Call a POISON CENTER or doctor/physicia

RUO – Research Use Only