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About This Item
Linear Formula:
FC6H4CH2SH
CAS Number:
Molecular Weight:
142.19
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Quality Level
Assay
96%
refractive index
n20/D 1.545 (lit.)
bp
72-74 °C/15 mmHg (lit.)
density
1.157 g/mL at 25 °C (lit.)
SMILES string
Fc1ccc(CS)cc1
InChI
1S/C7H7FS/c8-7-3-1-6(5-9)2-4-7/h1-4,9H,5H2
InChI key
RKTRHMNWVZRZJQ-UHFFFAOYSA-N
General description
4-Fluorobenzyl mercaptan undergoes reaction with p-chloranil to afford mainly 2,5-dichloro-3,6-S-disubstituted benzoquinone and 2,6-dichloro-3,5-S-disubstituted benzoquinone.
Application
4-Fluorobenzyl mercaptan may be used in the synthesis of the degradation products of fluorapacin, namely bis(4-fluorobenzyl)disulfide and bis(4-fluorobenzyl)tetrasulfide.
WGK
WGK 3
Flash Point(F)
170.0 °F
Flash Point(C)
76.67 °C
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Certificates of Analysis (COA)
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The synthesis of new cyclic thioquinone derivatives.
Ibis C and Ozsoy-Gunes Z.
Heteroatom Chem., 21(6), 446-452 (2010)
Yimei Bao et al.
Journal of pharmaceutical and biomedical analysis, 48(3), 664-671 (2008-08-06)
Bis(4-fluorobenzyl)trisulfide, fluorapacin, has been extensively developed as a promising new anticancer drug candidate. Its degradation products were identified and verified by the newly synthesized compounds bis(4-fluorobenzyl)disulfide (A) and bis(4-fluorobenzyl)tetrasulfide (B) which were resulted from the disproportionation of fluorapacin under forced
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