lithium;amino(fluoro)methanesulfinate;hydride

CH4FLiNO2S- — CID 174808925

IUPAClithium;amino(fluoro)methanesulfinate;hydride
SMILESNC(F)S(=O)[O-].[H-].[Li+]
InChIInChI=1S/CH4FNO2S.Li.H/c2-1(3)6(4)5;;/h1H,3H2,(H,4,5);;/q;+1;-1/p-1
InChIKeyKVXQUPLYXCWDST-UHFFFAOYSA-M
MW120.05 g/mol
LogP-3.81
Rot. Bonds1

About lithium;amino(fluoro)methanesulfinate;hydride

lithium;amino(fluoro)methanesulfinate;hydride (PubChem CID 174808925) has the molecular formula CH4FLiNO2S- and a molecular weight of 120.05 g/mol. Its IUPAC name is lithium;amino(fluoro)methanesulfinate;hydride.

Molecular Properties

Compound Namelithium;amino(fluoro)methanesulfinate;hydride
PubChem CID174808925
Molecular FormulaCH4FLiNO2S-
Molecular Weight120.05 g/mol
Exact Mass120.01
IUPAC Namelithium;amino(fluoro)methanesulfinate;hydride
SMILESNC(F)S(=O)[O-].[H-].[Li+]
InChIInChI=1S/CH4FNO2S.Li.H/c2-1(3)6(4)5;;/h1H,3H2,(H,4,5);;/q;+1;-1/p-1
InChIKeyKVXQUPLYXCWDST-UHFFFAOYSA-M
XLogP-3.81
TPSA66.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.05
LogP ≤ 5-3.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}, {'alert_name': 'sulfinic_acid', 'substructure': 'N/A'}

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Related Compounds

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dimethylphosphoryl(fluoro)methanesulfinate;rhenium
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lithium;hydride;1,1,2,2,3,3,4,4-octafluorobutane-1,4-disulfinate
CID 174871743
fluoro(phenyl)methanesulfinate
CID 18935920
1,2,2-trifluoro-2-methoxyethanesulfinate
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Frequently Asked Questions

What is the IUPAC name of lithium;amino(fluoro)methanesulfinate;hydride?
The IUPAC name of lithium;amino(fluoro)methanesulfinate;hydride (CID 174808925) is lithium;amino(fluoro)methanesulfinate;hydride.
What is the SMILES notation for lithium;amino(fluoro)methanesulfinate;hydride?
The canonical SMILES for lithium;amino(fluoro)methanesulfinate;hydride is NC(F)S(=O)[O-].[H-].[Li+].
What is the InChIKey of lithium;amino(fluoro)methanesulfinate;hydride?
The InChIKey is KVXQUPLYXCWDST-UHFFFAOYSA-M. The full InChI is InChI=1S/CH4FNO2S.Li.H/c2-1(3)6(4)5;;/h1H,3H2,(H,4,5);;/q;+1;-1/p-1.
What are the key properties of lithium;amino(fluoro)methanesulfinate;hydride?
lithium;amino(fluoro)methanesulfinate;hydride has a molecular weight of 120.05 g/mol, XLogP of -3.81, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;amino(fluoro)methanesulfinate;hydride is sourced from PubChem (CID 174808925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).