CID 173484467

ClCrO2S- — CID 173484467

IUPAC—
SMILESO=[S-](=O)Cl.[Cr]
InChIInChI=1S/ClO2S.Cr/c1-4(2)3;/q-1;
InChIKeyDZGMIMRQOFBIDG-UHFFFAOYSA-N
MW151.51 g/mol
LogP0.45
Rot. Bonds

About CID 173484467

CID 173484467 (PubChem CID 173484467) has the molecular formula ClCrO2S- and a molecular weight of 151.51 g/mol.

Molecular Properties

Compound NameCID 173484467
PubChem CID173484467
Molecular FormulaClCrO2S-
Molecular Weight151.51 g/mol
Exact Mass150.87
IUPAC Name—
SMILESO=[S-](=O)Cl.[Cr]
InChIInChI=1S/ClO2S.Cr/c1-4(2)3;/q-1;
InChIKeyDZGMIMRQOFBIDG-UHFFFAOYSA-N
XLogP0.45
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.51
LogP ≤ 50.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 173484467?
The IUPAC name of CID 173484467 (CID 173484467) is not available.
What is the SMILES notation for CID 173484467?
The canonical SMILES for CID 173484467 is O=[S-](=O)Cl.[Cr].
What is the InChIKey of CID 173484467?
The InChIKey is DZGMIMRQOFBIDG-UHFFFAOYSA-N. The full InChI is InChI=1S/ClO2S.Cr/c1-4(2)3;/q-1;.
What are the key properties of CID 173484467?
CID 173484467 has a molecular weight of 151.51 g/mol, XLogP of 0.45, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173484467 is sourced from PubChem (CID 173484467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).