2-(pentafluoro-λ6-sulfanyl)pentan-1-ol

C5H11F5OS — CID 25263552

IUPAC2-(pentafluoro-λ6-sulfanyl)pentan-1-ol
SMILESCCCC(CO)S(F)(F)(F)(F)F
InChIInChI=1S/C5H11F5OS/c1-2-3-5(4-11)12(6,7,8,9)10/h5,11H,2-4H2,1H3
InChIKeyMOWVOKMIELMDSW-UHFFFAOYSA-N
MW214.20 g/mol
LogP3.45
Rot. Bonds4

About 2-(pentafluoro-λ6-sulfanyl)pentan-1-ol

2-(pentafluoro-λ6-sulfanyl)pentan-1-ol (PubChem CID 25263552) has the molecular formula C5H11F5OS and a molecular weight of 214.20 g/mol. Its IUPAC name is 2-(pentafluoro-λ6-sulfanyl)pentan-1-ol.

Molecular Properties

Compound Name2-(pentafluoro-λ6-sulfanyl)pentan-1-ol
PubChem CID25263552
Molecular FormulaC5H11F5OS
Molecular Weight214.20 g/mol
Exact Mass214.05
IUPAC Name2-(pentafluoro-λ6-sulfanyl)pentan-1-ol
SMILESCCCC(CO)S(F)(F)(F)(F)F
InChIInChI=1S/C5H11F5OS/c1-2-3-5(4-11)12(6,7,8,9)10/h5,11H,2-4H2,1H3
InChIKeyMOWVOKMIELMDSW-UHFFFAOYSA-N
XLogP3.45
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.20
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(pentafluoro-λ6-sulfanyl)pentan-1-ol?
The IUPAC name of 2-(pentafluoro-λ6-sulfanyl)pentan-1-ol (CID 25263552) is 2-(pentafluoro-λ6-sulfanyl)pentan-1-ol.
What is the SMILES notation for 2-(pentafluoro-λ6-sulfanyl)pentan-1-ol?
The canonical SMILES for 2-(pentafluoro-λ6-sulfanyl)pentan-1-ol is CCCC(CO)S(F)(F)(F)(F)F.
What is the InChIKey of 2-(pentafluoro-λ6-sulfanyl)pentan-1-ol?
The InChIKey is MOWVOKMIELMDSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11F5OS/c1-2-3-5(4-11)12(6,7,8,9)10/h5,11H,2-4H2,1H3.
What are the key properties of 2-(pentafluoro-λ6-sulfanyl)pentan-1-ol?
2-(pentafluoro-λ6-sulfanyl)pentan-1-ol has a molecular weight of 214.20 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(pentafluoro-λ6-sulfanyl)pentan-1-ol is sourced from PubChem (CID 25263552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).