[(2R)-1,1,1,2,3-pentafluoropropan-2-yl]benzene

C9H7F5 — CID 124636792

IUPAC[(2R)-1,1,1,2,3-pentafluoropropan-2-yl]benzene
SMILESFC[C@](F)(c1ccccc1)C(F)(F)F
InChIInChI=1S/C9H7F5/c10-6-8(11,9(12,13)14)7-4-2-1-3-5-7/h1-5H,6H2/t8-/m0/s1
InChIKeyGUVTZTNJOUZPIS-QMMMGPOBSA-N
MW210.15 g/mol
LogP3.38
Rot. Bonds2

About [(2R)-1,1,1,2,3-pentafluoropropan-2-yl]benzene

[(2R)-1,1,1,2,3-pentafluoropropan-2-yl]benzene (PubChem CID 124636792) has the molecular formula C9H7F5 and a molecular weight of 210.15 g/mol. Its IUPAC name is [(2R)-1,1,1,2,3-pentafluoropropan-2-yl]benzene.

Molecular Properties

Compound Name[(2R)-1,1,1,2,3-pentafluoropropan-2-yl]benzene
PubChem CID124636792
Molecular FormulaC9H7F5
Molecular Weight210.15 g/mol
Exact Mass210.05
IUPAC Name[(2R)-1,1,1,2,3-pentafluoropropan-2-yl]benzene
SMILESFC[C@](F)(c1ccccc1)C(F)(F)F
InChIInChI=1S/C9H7F5/c10-6-8(11,9(12,13)14)7-4-2-1-3-5-7/h1-5H,6H2/t8-/m0/s1
InChIKeyGUVTZTNJOUZPIS-QMMMGPOBSA-N
XLogP3.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.15
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

Biphenyl
CID 7095
Alpha-Methylstyrene
CID 7407
Ethylbenzene
CID 7500
Styrene
CID 7501
Cumene
CID 7406
Butylbenzene
CID 7705
Pentylbenzene
CID 10864
Propylbenzene
CID 7668
Tert-Butylbenzene
CID 7366
Isobutylbenzene
CID 10870
Allylbenzene
CID 9309
Sec-Butylbenzene
CID 8680

Frequently Asked Questions

What is the IUPAC name of [(2R)-1,1,1,2,3-pentafluoropropan-2-yl]benzene?
The IUPAC name of [(2R)-1,1,1,2,3-pentafluoropropan-2-yl]benzene (CID 124636792) is [(2R)-1,1,1,2,3-pentafluoropropan-2-yl]benzene.
What is the SMILES notation for [(2R)-1,1,1,2,3-pentafluoropropan-2-yl]benzene?
The canonical SMILES for [(2R)-1,1,1,2,3-pentafluoropropan-2-yl]benzene is FC[C@](F)(c1ccccc1)C(F)(F)F.
What is the InChIKey of [(2R)-1,1,1,2,3-pentafluoropropan-2-yl]benzene?
The InChIKey is GUVTZTNJOUZPIS-QMMMGPOBSA-N. The full InChI is InChI=1S/C9H7F5/c10-6-8(11,9(12,13)14)7-4-2-1-3-5-7/h1-5H,6H2/t8-/m0/s1.
What are the key properties of [(2R)-1,1,1,2,3-pentafluoropropan-2-yl]benzene?
[(2R)-1,1,1,2,3-pentafluoropropan-2-yl]benzene has a molecular weight of 210.15 g/mol, XLogP of 3.38, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1,1,1,2,3-pentafluoropropan-2-yl]benzene is sourced from PubChem (CID 124636792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).