nonane-1,9-dithiol;silver

C9H20AgS2 — CID 87575502

IUPACnonane-1,9-dithiol;silver
SMILESSCCCCCCCCCS.[Ag]
InChIInChI=1S/C9H20S2.Ag/c10-8-6-4-2-1-3-5-7-9-11;/h10-11H,1-9H2;
InChIKeyDGAKQJHVXVHOAD-UHFFFAOYSA-N
MW300.26 g/mol
LogP3.57
Rot. Bonds8

About nonane-1,9-dithiol;silver

nonane-1,9-dithiol;silver (PubChem CID 87575502) has the molecular formula C9H20AgS2 and a molecular weight of 300.26 g/mol. Its IUPAC name is nonane-1,9-dithiol;silver.

Molecular Properties

Compound Namenonane-1,9-dithiol;silver
PubChem CID87575502
Molecular FormulaC9H20AgS2
Molecular Weight300.26 g/mol
Exact Mass299.01
IUPAC Namenonane-1,9-dithiol;silver
SMILESSCCCCCCCCCS.[Ag]
InChIInChI=1S/C9H20S2.Ag/c10-8-6-4-2-1-3-5-7-9-11;/h10-11H,1-9H2;
InChIKeyDGAKQJHVXVHOAD-UHFFFAOYSA-N
XLogP3.57
TPSA0.00 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.26
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of nonane-1,9-dithiol;silver?
The IUPAC name of nonane-1,9-dithiol;silver (CID 87575502) is nonane-1,9-dithiol;silver.
What is the SMILES notation for nonane-1,9-dithiol;silver?
The canonical SMILES for nonane-1,9-dithiol;silver is SCCCCCCCCCS.[Ag].
What is the InChIKey of nonane-1,9-dithiol;silver?
The InChIKey is DGAKQJHVXVHOAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20S2.Ag/c10-8-6-4-2-1-3-5-7-9-11;/h10-11H,1-9H2;.
What are the key properties of nonane-1,9-dithiol;silver?
nonane-1,9-dithiol;silver has a molecular weight of 300.26 g/mol, XLogP of 3.57, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for nonane-1,9-dithiol;silver is sourced from PubChem (CID 87575502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).