CID 159931303

C2HF6LiNOS — CID 159931303

IUPAC—
SMILES[H]N=S(=O)(C(F)(F)F)C(F)(F)F.[Li]
InChIInChI=1S/C2HF6NOS.Li/c3-1(4,5)11(9,10)2(6,7)8;/h9H;
InChIKeyWVPHDMWPRKOMCX-UHFFFAOYSA-N
MW208.03 g/mol
LogP1.69
Rot. Bonds

About CID 159931303

CID 159931303 (PubChem CID 159931303) has the molecular formula C2HF6LiNOS and a molecular weight of 208.03 g/mol.

Molecular Properties

Compound NameCID 159931303
PubChem CID159931303
Molecular FormulaC2HF6LiNOS
Molecular Weight208.03 g/mol
Exact Mass207.98
IUPAC Name—
SMILES[H]N=S(=O)(C(F)(F)F)C(F)(F)F.[Li]
InChIInChI=1S/C2HF6NOS.Li/c3-1(4,5)11(9,10)2(6,7)8;/h9H;
InChIKeyWVPHDMWPRKOMCX-UHFFFAOYSA-N
XLogP1.69
TPSA40.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.03
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 159931303?
The IUPAC name of CID 159931303 (CID 159931303) is not available.
What is the SMILES notation for CID 159931303?
The canonical SMILES for CID 159931303 is [H]N=S(=O)(C(F)(F)F)C(F)(F)F.[Li].
What is the InChIKey of CID 159931303?
The InChIKey is WVPHDMWPRKOMCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C2HF6NOS.Li/c3-1(4,5)11(9,10)2(6,7)8;/h9H;.
What are the key properties of CID 159931303?
CID 159931303 has a molecular weight of 208.03 g/mol, XLogP of 1.69, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 159931303 is sourced from PubChem (CID 159931303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).