S-Ethyl trifluorothioacetate
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S-Ethyl trifluorothioacetate
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CAS No:
383-64-2
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Formula:
C4H5F3OS
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Chemical Name:
S-Ethyl trifluorothioacetate
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Synonyms:
Ethanethioic acid,2,2,2-trifluoro-,S-ethyl ester;Acetic acid,trifluorothio-,S-ethyl ester;Ethanethioic acid,trifluoro-,S-ethyl ester;S-Ethyl trifluorothioacetate;Trifluoroethanethioic acid S-ethyl ester;S-Ethyl thiotrifluoroacetate;NSC 88936;1-(Ethylsulfanyl)-2,2,2-trifluoroethan-1-one
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CAS No:
S-Ethyl trifluorothioacetate Basic Attributes
158.14
158.14
206-852-1
88936
DTXSID2059936
2930909090
Characteristics
42.37000
1.82840
1.2338 g/cm3 @ Temp: 425.5 °C
90.5 °C(lit.)
39 °F
n20/D 1.376(lit.)
Store at RT.
Safety Information
II
3.1
UN 3272 3/PG 2
3
11-36/37/38
16-26-36
F,Xi
Flammable/Irritant
P210-P261-P305 + P351 + P338
H225-H315-H319-H335
S-Ethyl trifluorothioacetate Use and Manufacturing
Ethanethioic acid, 2,2,2-trifluoro-, S-ethyl ester: INACTIVE
Computed Properties
Molecular Weight:158.14
XLogP3:2.1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:158.00132044
Monoisotopic Mass:158.00132044
Topological Polar Surface Area:42.4
Heavy Atom Count:9
Complexity:109
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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