[chloromethyl(methyl)-lambda4-sulfanylidene]chromium

C2H5ClCrS — CID 522166

IUPAC[chloromethyl(methyl)-lambda4-sulfanylidene]chromium
SMILESCS(=[Cr])CCl
InChIInChI=1S/C2H5ClS.Cr/c1-4-2-3;/h2H2,1H3;
InChIKeyGRIVQZIIRNULTE-UHFFFAOYSA-N
MW148.58 g/mol
LogP1.54
Rot. Bonds1

About [chloromethyl(methyl)-lambda4-sulfanylidene]chromium

[chloromethyl(methyl)-lambda4-sulfanylidene]chromium (PubChem CID 522166) has the molecular formula C2H5ClCrS and a molecular weight of 148.58 g/mol. Its IUPAC name is [chloromethyl(methyl)-lambda4-sulfanylidene]chromium.

Molecular Properties

Compound Name[chloromethyl(methyl)-lambda4-sulfanylidene]chromium
PubChem CID522166
Molecular FormulaC2H5ClCrS
Molecular Weight148.58 g/mol
Exact Mass147.92
IUPAC Name[chloromethyl(methyl)-lambda4-sulfanylidene]chromium
SMILESCS(=[Cr])CCl
InChIInChI=1S/C2H5ClS.Cr/c1-4-2-3;/h2H2,1H3;
InChIKeyGRIVQZIIRNULTE-UHFFFAOYSA-N
XLogP1.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.58
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [chloromethyl(methyl)-lambda4-sulfanylidene]chromium?
The IUPAC name of [chloromethyl(methyl)-lambda4-sulfanylidene]chromium (CID 522166) is [chloromethyl(methyl)-lambda4-sulfanylidene]chromium.
What is the SMILES notation for [chloromethyl(methyl)-lambda4-sulfanylidene]chromium?
The canonical SMILES for [chloromethyl(methyl)-lambda4-sulfanylidene]chromium is CS(=[Cr])CCl.
What is the InChIKey of [chloromethyl(methyl)-lambda4-sulfanylidene]chromium?
The InChIKey is GRIVQZIIRNULTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5ClS.Cr/c1-4-2-3;/h2H2,1H3;.
What are the key properties of [chloromethyl(methyl)-lambda4-sulfanylidene]chromium?
[chloromethyl(methyl)-lambda4-sulfanylidene]chromium has a molecular weight of 148.58 g/mol, XLogP of 1.54, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [chloromethyl(methyl)-lambda4-sulfanylidene]chromium is sourced from PubChem (CID 522166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).