lithium;hydride;methyl fluorosulfonylformate

C2H4FLiO4S — CID 175482440

IUPAClithium;hydride;methyl fluorosulfonylformate
SMILESCOC(=O)S(=O)(=O)F.[H-].[Li+]
InChIInChI=1S/C2H3FO4S.Li.H/c1-7-2(4)8(3,5)6;;/h1H3;;/q;+1;-1
InChIKeyOQPZEZZWMZMLFX-UHFFFAOYSA-N
MW150.06 g/mol
LogP-2.83
Rot. Bonds

About lithium;hydride;methyl fluorosulfonylformate

lithium;hydride;methyl fluorosulfonylformate (PubChem CID 175482440) has the molecular formula C2H4FLiO4S and a molecular weight of 150.06 g/mol. Its IUPAC name is lithium;hydride;methyl fluorosulfonylformate.

Molecular Properties

Compound Namelithium;hydride;methyl fluorosulfonylformate
PubChem CID175482440
Molecular FormulaC2H4FLiO4S
Molecular Weight150.06 g/mol
Exact Mass150.00
IUPAC Namelithium;hydride;methyl fluorosulfonylformate
SMILESCOC(=O)S(=O)(=O)F.[H-].[Li+]
InChIInChI=1S/C2H3FO4S.Li.H/c1-7-2(4)8(3,5)6;;/h1H3;;/q;+1;-1
InChIKeyOQPZEZZWMZMLFX-UHFFFAOYSA-N
XLogP-2.83
TPSA60.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.06
LogP ≤ 5-2.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thioester', 'substructure': 'N/A'}

Analyze lithium;hydride;methyl fluorosulfonylformate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl propan-2-ylsulfonylformate
CID 117037052
methyl propanoate;sulfuryl difluoride
CID 146421317
methyl (2S)-3-fluorosulfonyl-2-methylpropanoate
CID 124709340
methyl 2-fluoro-2-fluorosulfonylacetate
CID 12779300
methanesulfonic acid;methyl acetate
CID 172690689
methyl hydrogen carbonate;sulfuric acid
CID 172863213
lithium;hydride;methanesulfonyl fluoride
CID 175576597
(trifluoro-λ4-sulfanyl) acetate
CID 87285354
magnesium;dimethyl carbonate;hydride
CID 173223307
methyl prop-2-enoate;sulfuric acid
CID 174506127
methyl (2R)-4-methyl-2-(trifluoromethylsulfonyloxy)pentanoate
CID 11747870
disodium;methyl acetate;sulfate
CID 158946588

Frequently Asked Questions

What is the IUPAC name of lithium;hydride;methyl fluorosulfonylformate?
The IUPAC name of lithium;hydride;methyl fluorosulfonylformate (CID 175482440) is lithium;hydride;methyl fluorosulfonylformate.
What is the SMILES notation for lithium;hydride;methyl fluorosulfonylformate?
The canonical SMILES for lithium;hydride;methyl fluorosulfonylformate is COC(=O)S(=O)(=O)F.[H-].[Li+].
What is the InChIKey of lithium;hydride;methyl fluorosulfonylformate?
The InChIKey is OQPZEZZWMZMLFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H3FO4S.Li.H/c1-7-2(4)8(3,5)6;;/h1H3;;/q;+1;-1.
What are the key properties of lithium;hydride;methyl fluorosulfonylformate?
lithium;hydride;methyl fluorosulfonylformate has a molecular weight of 150.06 g/mol, XLogP of -2.83, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;hydride;methyl fluorosulfonylformate is sourced from PubChem (CID 175482440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).