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About This Item
Linear Formula:
(CF3)2C6H3CH2OH
CAS Number:
Molecular Weight:
244.13
UNSPSC Code:
12352100
NACRES:
NA.22
PubChem Substance ID:
EC Number:
251-168-9
Beilstein/REAXYS Number:
2055358
MDL number:
Assay:
98%
Form:
solid
InChI key
BJTWPJOGDWRYDD-UHFFFAOYSA-N
InChI
1S/C9H6F6O/c10-8(11,12)6-1-5(4-16)2-7(3-6)9(13,14)15/h1-3,16H,4H2
SMILES string
OCc1cc(cc(c1)C(F)(F)F)C(F)(F)F
assay
98%
form
solid
signalword
Warning
hcodes
Hazard Classifications
Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3
target_organs
Respiratory system
Storage Class
11 - Combustible Solids
wgk
WGK 3
flash_point_f
208.4 °F - closed cup
flash_point_c
98 °C - closed cup
ppe
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Amide-based atropisomers in tachykinin NK1-receptor antagonists: synthesis and antagonistic activity of axially chiral N-benzylcarboxamide derivatives of 2,3,4,5-tetrahydro-6H-pyrido [2, 3-b][1,5] oxazocin-6-one.
Ishichi Y, et al.
Tetrahedron, 60(20), 4481-4490 (2004)
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