adamantane-2-sulfonyl fluoride

C10H15FO2S — CID 139363297

IUPACadamantane-2-sulfonyl fluoride
SMILESO=S(=O)(F)C1C2CC3CC(C2)CC1C3
InChIInChI=1S/C10H15FO2S/c11-14(12,13)10-8-2-6-1-7(4-8)5-9(10)3-6/h6-10H,1-5H2
InChIKeyDRFFKUANTPFJDT-UHFFFAOYSA-N
MW218.29 g/mol
LogP2.11
Rot. Bonds1

About adamantane-2-sulfonyl fluoride

adamantane-2-sulfonyl fluoride (PubChem CID 139363297) has the molecular formula C10H15FO2S and a molecular weight of 218.29 g/mol. Its IUPAC name is adamantane-2-sulfonyl fluoride.

Molecular Properties

Compound Nameadamantane-2-sulfonyl fluoride
PubChem CID139363297
Molecular FormulaC10H15FO2S
Molecular Weight218.29 g/mol
Exact Mass218.08
IUPAC Nameadamantane-2-sulfonyl fluoride
SMILESO=S(=O)(F)C1C2CC3CC(C2)CC1C3
InChIInChI=1S/C10H15FO2S/c11-14(12,13)10-8-2-6-1-7(4-8)5-9(10)3-6/h6-10H,1-5H2
InChIKeyDRFFKUANTPFJDT-UHFFFAOYSA-N
XLogP2.11
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.29
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of adamantane-2-sulfonyl fluoride?
The IUPAC name of adamantane-2-sulfonyl fluoride (CID 139363297) is adamantane-2-sulfonyl fluoride.
What is the SMILES notation for adamantane-2-sulfonyl fluoride?
The canonical SMILES for adamantane-2-sulfonyl fluoride is O=S(=O)(F)C1C2CC3CC(C2)CC1C3.
What is the InChIKey of adamantane-2-sulfonyl fluoride?
The InChIKey is DRFFKUANTPFJDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FO2S/c11-14(12,13)10-8-2-6-1-7(4-8)5-9(10)3-6/h6-10H,1-5H2.
What are the key properties of adamantane-2-sulfonyl fluoride?
adamantane-2-sulfonyl fluoride has a molecular weight of 218.29 g/mol, XLogP of 2.11, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for adamantane-2-sulfonyl fluoride is sourced from PubChem (CID 139363297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).