CAS
898748-15-7 Purity
96%
898748-15-7 Purity
96%
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6-Trifluoromethyl-2(3H)-benzothiazolone
CAS
898748-27-1
Catalog Number
ACM898748271
Category
Other Products
Molecular Weight
219.183670 [g/mol]
Molecular Formula
C8H4F3NOS
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Specification
Synonyms
898748-27-1, 6-(Trifluoromethyl)benzo[d]thiazol-2(3H)-one, 6--trifluoromethyl-2(3H)-benzothiazolone, PubChem21738, CTK8C1080, MolPort-020-002-270, ANW-65849, ZINC14985073, AKOS016005504, AK-87476, 2-Hydroxy-6-(trifluoromethyl)benzothiazole, KB-247315, FT-0688540, 6-(trifluoromethyl)-3H-1,3-benzothiazol-2-one, A843367
IUPAC Name
6-(trifluoromethyl)-3H-1,3-benzothiazol-2-one
Canonical SMILES
C1=CC2=C(C=C1C(F)(F)F)SC(=O)N2
InChI Key
KEZZFJQCDUJFJY-UHFFFAOYSA-N
Exact Mass
218.99700
H-Bond Acceptor
5
H-Bond Donor
1
Upstream Synthesis Route 1
- 1217302-63-0
- 898748-27-1
Reference: [1] Tetrahedron Letters, 2012, vol. 53, # 20, p. 2511 - 2513
Upstream Synthesis Route 2
- 68-12-2
- 163444-17-5
- 898748-27-1
Reference: [1] RSC Advances, 2014, vol. 4, # 12, p. 6090 - 6093
Upstream Synthesis Route 3
- 1217302-63-0
- 898748-27-1
Reference: [1]Tetrahedron Letters,2012,vol. 53,p. 2511 - 2513
Upstream Synthesis Route 4
- 68-12-2
- 163444-17-5
- 898748-27-1
Reference: [1]RSC Advances,2014,vol. 4,p. 6090 - 6093
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