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2-[[4-(TRIFLUOROMETHYL)PHENYL]THIO]BENZOICACID

2-[[4-(TRIFLUOROMETHYL)PHENYL]THIO]BENZOICACID structure

CAS No:
895-45-4
Formula:
C14H9F3O2S
Chemical Name:
2-[[4-(TRIFLUOROMETHYL)PHENYL]THIO]BENZOICACID
Synonyms:
Trifluoromethyl phenyl thio benzoic acid;2-(4'-TRIFLUOROMETHYLPHENYLTHIO)BENZOIC ACID;2-carboxy-4-(trifluoromethyl)diphenyl sulfide;2-[[4-(TRIFLUOROMETHYL)PHENYL]THIO] BENZOIC ACID

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2-[[4-(TRIFLUOROMETHYL)PHENYL]THIO]BENZOICACID Basic Attributes

Molecular Weight：

298.28000

Exact Mass：

298.02800

DSSTox ID：

DTXSID20586356

HScode：

2930909090

Characteristics

PSA：

62.60000

XLogP3：

4.55480

Density：

1.444g/cm3

Melting Point：

153-154ºC

Boiling Point：

394.384ºC at 760 mmHg

Flash Point：

192.317ºC

Refractive Index：

1.601

Safety Information

hazard class code：

36/37/38

safety instructions：

26-36/37/39

Computed Properties

Molecular Weight:298.28
XLogP3:4.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:298.02753519
Monoisotopic Mass:298.02753519
Topological Polar Surface Area:62.6
Heavy Atom Count:20
Complexity:338
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[[4-(TRIFLUOROMETHYL)PHENYL]THIO]BENZOICACID

Basic Attributes
Characteristics
Safety Information
Computed Properties

2-[[4-(TRIFLUOROMETHYL)PHENYL]THIO]BENZOICACID

SDS

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