thiolane;trichlorogold

C4H8AuCl3S — CID 12976015

IUPACthiolane;trichlorogold
SMILESC1CCSC1.Cl[Au](Cl)Cl
InChIInChI=1S/C4H8S.Au.3ClH/c1-2-4-5-3-1;;;;/h1-4H2;;3*1H/q;+3;;;/p-3
InChIKeyHPHZVOOLJMXCIA-UHFFFAOYSA-K
MW391.50 g/mol
LogP3.58
Rot. Bonds

About thiolane;trichlorogold

thiolane;trichlorogold (PubChem CID 12976015) has the molecular formula C4H8AuCl3S and a molecular weight of 391.50 g/mol. Its IUPAC name is thiolane;trichlorogold.

Molecular Properties

Compound Namethiolane;trichlorogold
PubChem CID12976015
Molecular FormulaC4H8AuCl3S
Molecular Weight391.50 g/mol
Exact Mass389.91
IUPAC Namethiolane;trichlorogold
SMILESC1CCSC1.Cl[Au](Cl)Cl
InChIInChI=1S/C4H8S.Au.3ClH/c1-2-4-5-3-1;;;;/h1-4H2;;3*1H/q;+3;;;/p-3
InChIKeyHPHZVOOLJMXCIA-UHFFFAOYSA-K
XLogP3.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.50
LogP ≤ 53.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of thiolane;trichlorogold?
The IUPAC name of thiolane;trichlorogold (CID 12976015) is thiolane;trichlorogold.
What is the SMILES notation for thiolane;trichlorogold?
The canonical SMILES for thiolane;trichlorogold is C1CCSC1.Cl[Au](Cl)Cl.
What is the InChIKey of thiolane;trichlorogold?
The InChIKey is HPHZVOOLJMXCIA-UHFFFAOYSA-K. The full InChI is InChI=1S/C4H8S.Au.3ClH/c1-2-4-5-3-1;;;;/h1-4H2;;3*1H/q;+3;;;/p-3.
What are the key properties of thiolane;trichlorogold?
thiolane;trichlorogold has a molecular weight of 391.50 g/mol, XLogP of 3.58, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for thiolane;trichlorogold is sourced from PubChem (CID 12976015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).