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4-(Methylthio)phenyl isothiocyanate

CAS#[15863-41-9]
G-codeGEO-01967
Molecular formulaC8H7NS2
Molecular weight181.27
Synonyms 1-Isothiocyanato-4-(methylthio)benzene
Structure of 4-(Methylthio)phenyl isothiocyanate

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Specification

Appearanceclear yellowish crystalline powder
Purity99,6% (GC)

Structural identification

CAS#[15863-41-9]
G-codeGEO-01967
SMILESCSc1ccc(cc1)N=C=S
InChIInChI=1S/C8H7NS2/c1-11-8-4-2-7(3-5-8)9-6-10/h2-5H,1H3
InChI KeyInChIKey=CEBAJHCAFXYWNT-UHFFFAOYSA-N
Download structure as .mol

Regulatory Information

Transport InformationTOXIC SOLID, ORGANIC, N.O.S. UN2811 6.1/PG III
GHS pictogram
GHS06_toxic
Signal WordDanger
Hazard Statements
H301 - H315 - H319

H301 – Toxic if swallowed.
H315 – Causes skin irritation.
H319 – Causes serious eye irritation.

Precautionary Statements
P301+P310 - P302+P352 - P305+P351+P338 - P330

P301+P310 – IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.
P302+P352 – IF ON SKIN: Wash with plenty of soap and water.
P305+P351+P338 – IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.
P330 – Rinse mouth.

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