CID 87103721

C2H4F6LiN2O4S2 — CID 87103721

IUPAC—
SMILESNS(=O)(=O)C(F)(F)F.NS(=O)(=O)C(F)(F)F.[Li]
InChIInChI=1S/2CH2F3NO2S.Li/c2*2-1(3,4)8(5,6)7;/h2*(H2,5,6,7);
InChIKeyKOMLXUNAWWFLRU-UHFFFAOYSA-N
MW305.13 g/mol
LogP-0.79
Rot. Bonds

About CID 87103721

CID 87103721 (PubChem CID 87103721) has the molecular formula C2H4F6LiN2O4S2 and a molecular weight of 305.13 g/mol.

Molecular Properties

Compound NameCID 87103721
PubChem CID87103721
Molecular FormulaC2H4F6LiN2O4S2
Molecular Weight305.13 g/mol
Exact Mass304.97
IUPAC Name—
SMILESNS(=O)(=O)C(F)(F)F.NS(=O)(=O)C(F)(F)F.[Li]
InChIInChI=1S/2CH2F3NO2S.Li/c2*2-1(3,4)8(5,6)7;/h2*(H2,5,6,7);
InChIKeyKOMLXUNAWWFLRU-UHFFFAOYSA-N
XLogP-0.79
TPSA120.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.13
LogP ≤ 5-0.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 174361044
1,1,2,2,3,3-hexafluoro-3-sulfamoylpropane-1-sulfonic acid
CID 151994142
1,2,2,2-tetrafluoro-1-(trifluoromethoxy)ethanesulfonamide
CID 54257019
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Frequently Asked Questions

What is the IUPAC name of CID 87103721?
The IUPAC name of CID 87103721 (CID 87103721) is not available.
What is the SMILES notation for CID 87103721?
The canonical SMILES for CID 87103721 is NS(=O)(=O)C(F)(F)F.NS(=O)(=O)C(F)(F)F.[Li].
What is the InChIKey of CID 87103721?
The InChIKey is KOMLXUNAWWFLRU-UHFFFAOYSA-N. The full InChI is InChI=1S/2CH2F3NO2S.Li/c2*2-1(3,4)8(5,6)7;/h2*(H2,5,6,7);.
What are the key properties of CID 87103721?
CID 87103721 has a molecular weight of 305.13 g/mol, XLogP of -0.79, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 87103721 is sourced from PubChem (CID 87103721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).