azane;(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)benzene

C15H16F6N2 — CID 18759354

IUPACazane;(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)benzene
SMILESFC(F)(F)C(c1ccccc1)(c1ccccc1)C(F)(F)F.N.N
InChIInChI=1S/C15H10F6.2H3N/c16-14(17,18)13(15(19,20)21,11-7-3-1-4-8-11)12-9-5-2-6-10-12;;/h1-10H;2*1H3
InChIKeyKWQUDRBSBDUHHF-UHFFFAOYSA-N
MW338.30 g/mol
LogP5.42
Rot. Bonds2

About azane;(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)benzene

azane;(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)benzene (PubChem CID 18759354) has the molecular formula C15H16F6N2 and a molecular weight of 338.30 g/mol. Its IUPAC name is azane;(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)benzene.

Molecular Properties

Compound Nameazane;(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)benzene
PubChem CID18759354
Molecular FormulaC15H16F6N2
Molecular Weight338.30 g/mol
Exact Mass338.12
IUPAC Nameazane;(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)benzene
SMILESFC(F)(F)C(c1ccccc1)(c1ccccc1)C(F)(F)F.N.N
InChIInChI=1S/C15H10F6.2H3N/c16-14(17,18)13(15(19,20)21,11-7-3-1-4-8-11)12-9-5-2-6-10-12;;/h1-10H;2*1H3
InChIKeyKWQUDRBSBDUHHF-UHFFFAOYSA-N
XLogP5.42
TPSA70.00 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.30
LogP ≤ 55.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of azane;(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)benzene?
The IUPAC name of azane;(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)benzene (CID 18759354) is azane;(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)benzene.
What is the SMILES notation for azane;(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)benzene?
The canonical SMILES for azane;(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)benzene is FC(F)(F)C(c1ccccc1)(c1ccccc1)C(F)(F)F.N.N.
What is the InChIKey of azane;(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)benzene?
The InChIKey is KWQUDRBSBDUHHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F6.2H3N/c16-14(17,18)13(15(19,20)21,11-7-3-1-4-8-11)12-9-5-2-6-10-12;;/h1-10H;2*1H3.
What are the key properties of azane;(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)benzene?
azane;(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)benzene has a molecular weight of 338.30 g/mol, XLogP of 5.42, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azane;(1,1,1,3,3,3-hexafluoro-2-phenylpropan-2-yl)benzene is sourced from PubChem (CID 18759354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).