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ζ-Oxo-4-(trifluoromethyl)benzeneheptanenitrile

ζ-Oxo-4-(trifluoromethyl)benzeneheptanenitrile structure

CAS No:
898783-72-7
Formula:
C14H14F3NO
Chemical Name:
ζ-Oxo-4-(trifluoromethyl)benzeneheptanenitrile
Synonyms:
Benzeneheptanenitrile,ζ-oxo-4-(trifluoromethyl)-;ζ-Oxo-4-(trifluoromethyl)benzeneheptanenitrile

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ζ-Oxo-4-(trifluoromethyl)benzeneheptanenitrile Basic Attributes

Molecular Weight：

269.26200

Exact Mass：

269.26

DSSTox ID：

DTXSID70642279

HScode：

2926909090

Characteristics

PSA：

40.86000

XLogP3：

4.36218

Density：

1.168g/cm3

Boiling Point：

392.2ºC at 760 mmHg

Flash Point：

191ºC

Refractive Index：

1.47

Computed Properties

Molecular Weight:269.26
XLogP3:3.4
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:269.10274856
Monoisotopic Mass:269.10274856
Topological Polar Surface Area:40.9
Heavy Atom Count:19
Complexity:334
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of ζ-Oxo-4-(trifluoromethyl)benzeneheptanenitrile

Basic Attributes
Characteristics
Computed Properties

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