76755
Pentafluorophenyl isothiocyanate
≥97.0% (GC)
Synonym(s):
1,2,3,4,5-pentafluoro-6-isothiocyanatobenzene
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About This Item
Empirical Formula (Hill Notation):
C7F5NS
CAS Number:
Molecular Weight:
225.14
UNSPSC Code:
12352200
NACRES:
NA.25
PubChem Substance ID:
EC Number:
252-791-9
Beilstein/REAXYS Number:
2736207
MDL number:
Quality Level
assay
≥97.0% (GC)
form
liquid
refractive index
n20/D 1.540
bp
38-39 °C/0.2 mmHg (lit.)
density
1.594 g/mL at 20 °C (lit.)
storage temp.
2-8°C
SMILES string
Fc1c(F)c(F)c(N=C=S)c(F)c1F
InChI
1S/C7F5NS/c8-2-3(9)5(11)7(13-1-14)6(12)4(2)10
InChI key
NGNKMRBGZPDABE-UHFFFAOYSA-N
signalword
Danger
Hazard Classifications
Acute Tox. 4 Oral - Eye Irrit. 2 - Resp. Sens. 1 - Skin Irrit. 2 - Skin Sens. 1 - STOT SE 3
target_organs
Respiratory system
Storage Class
6.1D - Non-combustible acute toxic Cat.3 / toxic hazardous materials or hazardous materials causing chronic effects
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
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Per Rydberg et al.
Chemical research in toxicology, 15(4), 570-581 (2002-04-16)
Adducts to N-terminal valine residues in hemoglobin (Hb) are used for monitoring in vivo doses of electrophiles and are quantitated by means of a modified Edman procedure, the "N-alkyl Edman procedure". In the reaction with pentafluorophenyl isothiocyanate, N-alkylated valines cyclize
Katharina Goempel et al.
Archives of toxicology, 91(11), 3551-3560 (2017-05-24)
The aim of the present study was to explore the relation of controlled dietary acrylamide (AA) intake with the excretion of AA-related urinary mercapturic acids (MA), N-acetyl-S-(carbamoylethyl)-L-cysteine (AAMA) and N-acetyl-S-(1-carbamoyl-2-hydroxyethyl)-L-cysteine (GAMA). Excretion kinetics of these short-term exposure biomarkers were monitored
J A Barden et al.
Biochemistry, 29(5), 1348-1354 (1990-02-06)
Actin was labeled with pentafluorophenyl isothiocyanate at Lys-61. The label was sufficiently small not to affect the rate or extent of actin polymerization unlike the much larger fluorescein 5-isothiocyanate which completely inhibits actin polymerization [Burtnick, L. D. (1984) Biochim. Biophys.
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 1661002-250MG | 04061833833452 |
| Y0002374 | 04065272730693 |
| T1019-10MG | 04061837336386 |
| T1022-1ML | 04061837336423 |
| 76755-1ML | 04061832924281 |
| 76755-5ML | 04061837839214 |