CAS
13333-86-3 Purity
96%
13333-86-3 Purity
96%
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2-Trifluoromethyl thiophenol
CAS
13333-97-6
Catalog Number
ACM13333976
Category
Other Products
Molecular Weight
178.17
Molecular Formula
C7H5F3S
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Specification
Synonyms
2-(Trifluoromethyl)benzenethiol, 13333-97-6, 2-(Trifluoromethyl)thiophenol, 2-Trifluoromethyl thiophenol, 2-Mercaptobenzotrifluoride, 2-trifluoromethylthiophenol, SBB066490, 2-(trifluoromethyl)benzene-1-thiol, PubChem6860, ACMC-209brx, AC1MCS2B, SureCN72183, 2-(trifluoromethylthio)phenol, 542660_ALDRICH, CTK3J0579, MolPort-000-147-016, ANW-19531, AKOS005254913, AG-D-67881, RP23941
IUPAC Name
2-(trifluoromethyl)benzenethiol
SMILES
C1=CC=C(C(=C1)C(F)(F)F)S
InChI Key
XVGQHRKNXSUPEF-UHFFFAOYSA-N
Boiling Point
50-177ºC(15 torr)
Flash Point
68ºC
Density
1.35
Appearance
light yellow liquid
Exact Mass
178.00600
Hazard Statements
Xn:Harmful;
H-Bond Acceptor
4
H-Bond Donor
1
Safety Description
S36/37
WGK Germany
3
Upstream Synthesis Route 1
- 392-83-6
- 13333-97-6
Reference: [1]Advanced Synthesis and Catalysis,2015,vol. 357,p. 2205 - 2212
[2]Patent: KR2017/76524,2017,A .Location in patent: Paragraph 0032; 0033; 0063; 0067; 0069; 0070; 0074
[3]Canadian Journal of Chemistry,1980,vol. 58,p. 2738 - 2744
Downstream Synthesis Route 1
- 13333-97-6
- 1869-24-5
Reference: [1] Organic Letters, 2018, vol. 20, # 9, p. 2599 - 2602
* For details of the synthesis route, please refer to the original source to ensure accuracy.
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