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p-Tolyl isothiocyanate, 97%

CAS: 622-59-3 | C8H7NS | 149.211 g/mol

$86.44 - $780.29

Chemical Identifiers

CAS 622-59-3
Molecular Formula C8H7NS
Molecular Weight (g/mol) 149.211
MDL Number MFCD00004813
InChI Key ABQKHKWXTUVKGF-UHFFFAOYSA-N
Synonym p-tolyl isothiocyanate, 4-methylphenyl isothiocyanate, 4-methylphenylisothiocyanate, p-tolylisothiocyanate, 4-tolylisothiocyanate, benzene, 1-isothiocyanato-4-methyl, 4-tolyl isothiocyanate, isothiocyanic acid, p-tolyl ester, 1-isothiocyanato-4-methyl-benzene, isothiocyanic acid, 4-tolyl ester
PubChem CID 12149
IUPAC Name 1-isothiocyanato-4-methylbenzene
SMILES CC1=CC=C(C=C1)N=C=S
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Products 3
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Catalog Number Mfr. No. Quantity Price Quantity  
AAA1149906
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Thermo Scientific Chemicals
A1149906
5 g
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AAA1149914
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Thermo Scientific Chemicals
A1149914
25 g
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AAA1149922
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Thermo Scientific Chemicals
A1149922
100 g
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Description

Description

p-Tolyl isothiocyanate has been used in the preparation of 6-[1-amino-3-(p-tolyl)-thiourea]-2-ethylbenzo[de]isoquinoline-1,3-dione. It is used as capping agent to cap the N-terminal ends of polypeptide. It is also used as pharmaceutical intermediate.

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

Applications
p-Tolyl isothiocyanate has been used in the preparation of 6-[1-amino-3-(p-tolyl)-thiourea]-2-ethylbenzo[de]isoquinoline-1,3-dione. It is used as capping agent to cap the N-terminal ends of polypeptide. It is also used as pharmaceutical intermediate.

Solubility
Decompose in water.

Notes
Moisture Sensitive. Protect from humidity and water. Store under dry inert gas away from oxidizing agents and moisture.
Specifications

Chemical Identifiers

622-59-3
149.211
ABQKHKWXTUVKGF-UHFFFAOYSA-N
12149
CC1=CC=C(C=C1)N=C=S
C8H7NS
MFCD00004813
p-tolyl isothiocyanate, 4-methylphenyl isothiocyanate, 4-methylphenylisothiocyanate, p-tolylisothiocyanate, 4-tolylisothiocyanate, benzene, 1-isothiocyanato-4-methyl, 4-tolyl isothiocyanate, isothiocyanic acid, p-tolyl ester, 1-isothiocyanato-4-methyl-benzene, isothiocyanic acid, 4-tolyl ester
1-isothiocyanato-4-methylbenzene

Specifications

622-59-3
236°C to 238°C
Pungent
1.6345
5 g
386032
p-tolyl isothiocyanate, 4-methylphenyl isothiocyanate, 4-methylphenylisothiocyanate, p-tolylisothiocyanate, 4-tolylisothiocyanate, benzene, 1-isothiocyanato-4-methyl, 4-tolyl isothiocyanate, isothiocyanic acid, p-tolyl ester, 1-isothiocyanato-4-methyl-benzene, isothiocyanic acid, 4-tolyl ester
ABQKHKWXTUVKGF-UHFFFAOYSA-N
1-isothiocyanato-4-methylbenzene
12149
97%
23°C to 26°C
107°C (224°F)
C8H7NS
MFCD00004813
UN2923
Moisture sensitive
Decompose in water.
CC1=CC=C(C=C1)N=C=S
149.211
149.22
p-Tolyl isothiocyanate
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Safety and Handling

Safety and Handling

GHS H Statement
H314-H318-H302-H312-H332
Causes severe skin burns and eye damage.
Causes serious eye damage.
Harmful if swallowed.
Harmful in contact with skin.
Harmful if inhaled.

P261-P264b-P270-P271-P272-P280-P285-P301+P310-P302+P352-P304+P340-P305+P351+P338-P311-P312-P330-P333+P313-P361-P363-P501c

H301+H311+H331-H315-H317-H319-H334-H335

DOTInformation : Hazard Class: 6.1; Packaging Group: II

EINECSNumber : 210-745-5

RTECSNumber : NX9500000

TSCA : No

Recommended Storage : Ambient temperatures; Store under Nitrogen

SDS
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RUO – Research Use Only