molecular hydrogen;(1S)-1-propan-2-ylbicyclo[2.1.0]pentane;hydrofluoride

C8H17F — CID 157031643

IUPACmolecular hydrogen;(1S)-1-propan-2-ylbicyclo[2.1.0]pentane;hydrofluoride
SMILESCC(C)[C@@]12CCC1C2.F.[H][H]
InChIInChI=1S/C8H14.FH.H2/c1-6(2)8-4-3-7(8)5-8;;/h6-7H,3-5H2,1-2H3;2*1H/t7?,8-;;/m0../s1
InChIKeyCLIORJUSTCIYMC-AEUOCKLGSA-N
MW132.22 g/mol
LogP2.84
Rot. Bonds1

About molecular hydrogen;(1S)-1-propan-2-ylbicyclo[2.1.0]pentane;hydrofluoride

molecular hydrogen;(1S)-1-propan-2-ylbicyclo[2.1.0]pentane;hydrofluoride (PubChem CID 157031643) has the molecular formula C8H17F and a molecular weight of 132.22 g/mol. Its IUPAC name is molecular hydrogen;(1S)-1-propan-2-ylbicyclo[2.1.0]pentane;hydrofluoride.

Molecular Properties

Compound Namemolecular hydrogen;(1S)-1-propan-2-ylbicyclo[2.1.0]pentane;hydrofluoride
PubChem CID157031643
Molecular FormulaC8H17F
Molecular Weight132.22 g/mol
Exact Mass132.13
IUPAC Namemolecular hydrogen;(1S)-1-propan-2-ylbicyclo[2.1.0]pentane;hydrofluoride
SMILESCC(C)[C@@]12CCC1C2.F.[H][H]
InChIInChI=1S/C8H14.FH.H2/c1-6(2)8-4-3-7(8)5-8;;/h6-7H,3-5H2,1-2H3;2*1H/t7?,8-;;/m0../s1
InChIKeyCLIORJUSTCIYMC-AEUOCKLGSA-N
XLogP2.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.22
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of molecular hydrogen;(1S)-1-propan-2-ylbicyclo[2.1.0]pentane;hydrofluoride?
The IUPAC name of molecular hydrogen;(1S)-1-propan-2-ylbicyclo[2.1.0]pentane;hydrofluoride (CID 157031643) is molecular hydrogen;(1S)-1-propan-2-ylbicyclo[2.1.0]pentane;hydrofluoride.
What is the SMILES notation for molecular hydrogen;(1S)-1-propan-2-ylbicyclo[2.1.0]pentane;hydrofluoride?
The canonical SMILES for molecular hydrogen;(1S)-1-propan-2-ylbicyclo[2.1.0]pentane;hydrofluoride is CC(C)[C@@]12CCC1C2.F.[H][H].
What is the InChIKey of molecular hydrogen;(1S)-1-propan-2-ylbicyclo[2.1.0]pentane;hydrofluoride?
The InChIKey is CLIORJUSTCIYMC-AEUOCKLGSA-N. The full InChI is InChI=1S/C8H14.FH.H2/c1-6(2)8-4-3-7(8)5-8;;/h6-7H,3-5H2,1-2H3;2*1H/t7?,8-;;/m0../s1.
What are the key properties of molecular hydrogen;(1S)-1-propan-2-ylbicyclo[2.1.0]pentane;hydrofluoride?
molecular hydrogen;(1S)-1-propan-2-ylbicyclo[2.1.0]pentane;hydrofluoride has a molecular weight of 132.22 g/mol, XLogP of 2.84, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for molecular hydrogen;(1S)-1-propan-2-ylbicyclo[2.1.0]pentane;hydrofluoride is sourced from PubChem (CID 157031643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).