naphthalen-1-ylmethanesulfonyl fluoride

C11H9FO2S — CID 151506364

IUPACnaphthalen-1-ylmethanesulfonyl fluoride
SMILESO=S(=O)(F)Cc1cccc2ccccc12
InChIInChI=1S/C11H9FO2S/c12-15(13,14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2
InChIKeyPRMYOVIVKHWRKV-UHFFFAOYSA-N
MW224.26 g/mol
LogP2.64
Rot. Bonds2

About naphthalen-1-ylmethanesulfonyl fluoride

naphthalen-1-ylmethanesulfonyl fluoride (PubChem CID 151506364) has the molecular formula C11H9FO2S and a molecular weight of 224.26 g/mol. Its IUPAC name is naphthalen-1-ylmethanesulfonyl fluoride.

Molecular Properties

Compound Namenaphthalen-1-ylmethanesulfonyl fluoride
PubChem CID151506364
Molecular FormulaC11H9FO2S
Molecular Weight224.26 g/mol
Exact Mass224.03
IUPAC Namenaphthalen-1-ylmethanesulfonyl fluoride
SMILESO=S(=O)(F)Cc1cccc2ccccc12
InChIInChI=1S/C11H9FO2S/c12-15(13,14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2
InChIKeyPRMYOVIVKHWRKV-UHFFFAOYSA-N
XLogP2.64
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of naphthalen-1-ylmethanesulfonyl fluoride?
The IUPAC name of naphthalen-1-ylmethanesulfonyl fluoride (CID 151506364) is naphthalen-1-ylmethanesulfonyl fluoride.
What is the SMILES notation for naphthalen-1-ylmethanesulfonyl fluoride?
The canonical SMILES for naphthalen-1-ylmethanesulfonyl fluoride is O=S(=O)(F)Cc1cccc2ccccc12.
What is the InChIKey of naphthalen-1-ylmethanesulfonyl fluoride?
The InChIKey is PRMYOVIVKHWRKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FO2S/c12-15(13,14)8-10-6-3-5-9-4-1-2-7-11(9)10/h1-7H,8H2.
What are the key properties of naphthalen-1-ylmethanesulfonyl fluoride?
naphthalen-1-ylmethanesulfonyl fluoride has a molecular weight of 224.26 g/mol, XLogP of 2.64, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalen-1-ylmethanesulfonyl fluoride is sourced from PubChem (CID 151506364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).