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2,4,5-TRIFLUOROANISOLE

2,4,5-TRIFLUOROANISOLE structure

CAS No:
5006-38-2
Formula:
C7H5F3O
Chemical Name:
2,4,5-TRIFLUOROANISOLE
Synonyms:
2,4,5-TRIFLUOROANISOLE;1,2,4-trifluoro-5-methoxybenzene;SCHEMBL2001415;CTK4J2036;DTXSID80407750;ZINC405260;AKOS006228307;MCULE-7417384088
Categories:
Organic Chemistry > Organic Fluorine Compound

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2,4,5-TRIFLUOROANISOLE Basic Attributes

Molecular Weight：

162.11

Exact Mass：

162.02900

DSSTox ID：

DTXSID80407750

Characteristics

PSA：

9.2

XLogP3：

2.11250

Density：

1.285g/cm3

Boiling Point：

152.8ºC at 760 mmHg

Flash Point：

58.3ºC

Refractive Index：

1.435

Safety Information

Packing level：

III

Hazard category：

4.1

Transport codes：

1325

Computed Properties

Molecular Weight:162.11
XLogP3:2.2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:162.02924926
Monoisotopic Mass:162.02924926
Topological Polar Surface Area:9.2
Heavy Atom Count:11
Complexity:131
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes