78780
Phenyl isothiocyanate
for HPLC derivatization, the detection of alcohols and amines, ≥99.0%
Sinónimos:
PITC
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Fórmula lineal:
C6H5NCS
Número CAS:
Peso molecular:
135.19
UNSPSC Code:
12352100
NACRES:
NA.21
PubChem Substance ID:
EC Number:
203-138-1
Beilstein/REAXYS Number:
471392
MDL number:
Assay:
≥99.0%
Form:
liquid
Servicio técnico
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Permítanos ayudarleQuality Level
assay
≥99.0%
form
liquid
quality
for HPLC derivatization, the detection of alcohols and amines
refractive index
n20/D 1.649, n20/D 1.6515 (lit.)
bp
218 °C (lit.)
mp
−21 °C (lit.)
solubility
water: insoluble
density
1.13 g/mL at 20 °C, 1.132 g/mL at 20 °C (lit.)
storage temp.
2-8°C
SMILES string
S=C=Nc1ccccc1
InChI
1S/C7H5NS/c9-6-8-7-4-2-1-3-5-7/h1-5H
InChI key
QKFJKGMPGYROCL-UHFFFAOYSA-N
General description
Phenyl isothiocyanate is an aromatic isothiocyanate. It participates in dehydration reactions of alcohols. It is widely used for synthesis of various biologically important heterocyclic compounds.
Application
Derivatizing reagent for primary and secondary amines. Used in sequencing peptides by Edman degradation and in amino acid analyses by HPLC.
Phenyl isothiocyanate may be employed as a derivatization reagent for high-performance liquid chromatographic (HPLC) analysis of various amphetamine derivatives in body fluids.
Disclaimer
Store under Argon
signalword
Danger
hcodes
Hazard Classifications
Acute Tox. 3 Oral - Resp. Sens. 1 - Skin Corr. 1B - Skin Sens. 1
Clase de almacenamiento
6.1A - Combustible acute toxic Cat. 1 and 2 / very toxic hazardous materials
wgk
WGK 3
flash_point_f
190.4 °F - closed cup
flash_point_c
88 °C - closed cup
ppe
Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
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Determination of phenylisothiocyanate derivatives of amphetamine and its analogues in biological fluids by HPLC-APCI-MS or DAD.
Bogusz MJ, et al.
Journal of Analytical Toxicology, 21(1), 59-69 (1997)
One-pot dehydrations using phenyl isothiocyanate.
Majetich G, et al.
Tetrahedron Letters, 56(23), 3326-3329 (2015)
Amin Zolali et al.
Combinatorial chemistry & high throughput screening, 17(7), 610-613 (2014-03-19)
An efficient, one-pot and three-component synthesis of biologically important heterocyclic compounds is described from the reaction of primary amines and phenyl isothiocyanate in the presence of acryloyl chloride at room temperature without the need to use any catalyst.