Phenyl isothiocyanate, 98%, Thermo Scientific Chemicals

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

103-72-0

Molecular Formula

C7H5NS

Molecular Weight (g/mol)

135.18

MDL Number

MFCD00004798

InChI Key

QKFJKGMPGYROCL-UHFFFAOYSA-N

Synonym

phenyl isothiocyanate, phenylisothiocyanate, thiocarbanil, phenyl mustard oil, benzene, isothiocyanato, pitc, isothiocyanic acid phenyl ester, benzene-1-isothiocyanate, phenylsenfoel, phenyl thioisocyanate

PubChem CID

7673

ChEBI

CHEBI:85103

IUPAC Name

isothiocyanatobenzene

SMILES

S=C=NC1=CC=CC=C1

Melting Point

-21.0°C

Color

Yellow

Density

1.1288g/mL

Boiling Point

221.0°C

Flash Point

87°C

Infrared Spectrum

Authentic

Assay Percent Range

97.5% min. (GC)

Packaging

Glass bottle

Refractive Index

1.6490 to 1.6510

Linear Formula

C₆H₅NCS

Quantity

100 g

Beilstein

12,453

Fieser

01,844; 02,323

Merck Index

15,7408

Specific Gravity

1.1288

Solubility Information

Solubility in water: insoluble. Other solubilities: soluble in ethanol and diethyl ether

Viscosity

1.3 mPa.s (20°C)

Formula Weight

135.19

Percent Purity

98%

Physical Form

Liquid

Chemical Name or Material

Phenyl isothiocyanate

Hazard Category

GHS Signal Word: Danger

Hazard Statement

GHS H Statement
Causes severe skin burns and eye damage.
May cause an allergic skin reaction.
Toxic in contact with skin.
Toxic if inhaled.
Toxic if swallowed.
Suspected of damaging the unborn child.

Precautionary Statement

GHS P Statement
Wear protective gloves/protective clothing/eye protection/face protection.
IF IN EYES: Rinse cautiously with water for several minutes.
Remove contact lenses,if present and easy to do.
Continue rinsing.
Immediately

EINECSNumber

203-138-1

SDS

Hazard Category

GHS Signal Word: Danger

Hazard Statement

GHS H Statement
Causes severe skin burns and eye damage.
May cause an allergic skin reaction.
Toxic in contact with skin.
Toxic if inhaled.
Toxic if swallowed.
Suspected of damaging the unborn child.

Precautionary Statement

GHS P Statement
Wear protective gloves/protective clothing/eye protection/face protection.
IF IN EYES: Rinse cautiously with water for several minutes.
Remove contact lenses,if present and easy to do.
Continue rinsing.
Immediately

EINECSNumber

203-138-1

SDS

RUO – Research Use Only