CAS 433-19-2 | 1,4-Di(Trifluoromethyl)Benzene | CAS Number 433-19-2

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433-19-2 | 1,4-Di(Trifluoromethyl)Benzene

CAS No: 433-19-2 Catalog No: AG003DNI MDL No:MFCD00000402

Product Description

Catalog Number:

AG003DNI

Chemical Name:

1,4-Di(Trifluoromethyl)Benzene

CAS Number:

433-19-2

Molecular Formula:

C8H4F6

Molecular Weight:

214.1078

MDL Number:

MFCD00000402

IUPAC Name:

1,4-bis(trifluoromethyl)benzene

InChI:

InChI=1S/C8H4F6/c9-7(10,11)5-1-2-6(4-3-5)8(12,13)14/h1-4H

InChI Key:

PDCBZHHORLHNCZ-UHFFFAOYSA-N

SMILES:

FC(c1ccc(cc1)C(F)(F)F)(F)F

EC Number:

207-086-0

NSC Number:

61992

Properties

Complexity:

161

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

214.022g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

214.11g/mol

Monoisotopic Mass:

214.022g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

0A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.8

Literature

Title	Journal
Relationship between the thermally induced reorientations of aromatic solvate molecules in Cu(hfac)2-nitroxide breathing crystals and the character of the magnetic anomaly.	Inorganic chemistry 20110718
Stereochemically inactive lone pairs in phosphorus(III) compounds: the characterisation of some derivatives with the 2,5-(CF3)2C6H3 (Ar) substituent and their complexation behaviour towards Pt(II) species.	Dalton transactions (Cambridge, England : 2003) 20110227
Signal turn-on probe for nucleic acid detection based on (19)F nuclear magnetic resonance.	Bioorganic & medicinal chemistry letters 20110101
Low-valent niobium-catalyzed reduction of alpha,alpha,alpha-trifluorotoluenes.	Organic letters 20070412