iodomethane;methanesulfonyl chloride

C2H6ClIO2S — CID 123541461

IUPACiodomethane;methanesulfonyl chloride
SMILESCI.CS(=O)(=O)Cl
InChIInChI=1S/CH3ClO2S.CH3I/c1-5(2,3)4;1-2/h1H3;1H3
InChIKeyFIIXWHCZPBXFDW-UHFFFAOYSA-N
MW256.49 g/mol
LogP1.24
Rot. Bonds

About iodomethane;methanesulfonyl chloride

iodomethane;methanesulfonyl chloride (PubChem CID 123541461) has the molecular formula C2H6ClIO2S and a molecular weight of 256.49 g/mol. Its IUPAC name is iodomethane;methanesulfonyl chloride.

Molecular Properties

Compound Nameiodomethane;methanesulfonyl chloride
PubChem CID123541461
Molecular FormulaC2H6ClIO2S
Molecular Weight256.49 g/mol
Exact Mass255.88
IUPAC Nameiodomethane;methanesulfonyl chloride
SMILESCI.CS(=O)(=O)Cl
InChIInChI=1S/CH3ClO2S.CH3I/c1-5(2,3)4;1-2/h1H3;1H3
InChIKeyFIIXWHCZPBXFDW-UHFFFAOYSA-N
XLogP1.24
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.49
LogP ≤ 51.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

fluoroform;methanesulfonyl chloride
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CID 158267417
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imino-iodo-methyl-oxo-λ6-sulfane
CID 89488893
dimethyltin;sulfuryl dichloride
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CID 174964861

Frequently Asked Questions

What is the IUPAC name of iodomethane;methanesulfonyl chloride?
The IUPAC name of iodomethane;methanesulfonyl chloride (CID 123541461) is iodomethane;methanesulfonyl chloride.
What is the SMILES notation for iodomethane;methanesulfonyl chloride?
The canonical SMILES for iodomethane;methanesulfonyl chloride is CI.CS(=O)(=O)Cl.
What is the InChIKey of iodomethane;methanesulfonyl chloride?
The InChIKey is FIIXWHCZPBXFDW-UHFFFAOYSA-N. The full InChI is InChI=1S/CH3ClO2S.CH3I/c1-5(2,3)4;1-2/h1H3;1H3.
What are the key properties of iodomethane;methanesulfonyl chloride?
iodomethane;methanesulfonyl chloride has a molecular weight of 256.49 g/mol, XLogP of 1.24, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for iodomethane;methanesulfonyl chloride is sourced from PubChem (CID 123541461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).