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2,5-Bis(trifluoromethyl)phenylisothiocyanate

2,5-Bis(trifluoromethyl)phenylisothiocyanate structure

CAS No:
512179-73-6
Formula:
C9H3F6NS
Chemical Name:
2,5-Bis(trifluoromethyl)phenylisothiocyanate
Synonyms:
2,5-bis(trifluoromethyl)phenylisothiocyanate;512179-73-6;2-isothiocyanato-1,4-bis(trifluoromethyl)benzene;SCHEMBL7057873;CTK8A7551;ZINC15444471

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2,5-Bis(trifluoromethyl)phenylisothiocyanate Basic Attributes

Molecular Weight：

271.1822392

Exact Mass：

270.989

Characteristics

PSA：

44.4

XLogP3：

5.1

Computed Properties

Molecular Weight:271.18
XLogP3:5.1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:1
Exact Mass:270.98903925
Monoisotopic Mass:270.98903925
Topological Polar Surface Area:44.4
Heavy Atom Count:17
Complexity:316
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2,5-Bis(trifluoromethyl)phenylisothiocyanate

Basic Attributes
Characteristics
Computed Properties

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