bis(cyclopropylmethoxymethanedithiolate);platinum(4+)

C10H16O2PtS4 — CID 44826214

IUPACbis(cyclopropylmethoxymethanedithiolate);platinum(4+)
SMILES[Pt+4].[S-]C([S-])OCC1CC1.[S-]C([S-])OCC1CC1
InChIInChI=1S/2C5H10OS2.Pt/c2*7-5(8)6-3-4-1-2-4;/h2*4-5,7-8H,1-3H2;/q;;+4/p-4
InChIKeyJRMRYKKKXYVOCN-UHFFFAOYSA-J
MW491.58 g/mol
LogP1.58
Rot. Bonds6

About bis(cyclopropylmethoxymethanedithiolate);platinum(4+)

bis(cyclopropylmethoxymethanedithiolate);platinum(4+) (PubChem CID 44826214) has the molecular formula C10H16O2PtS4 and a molecular weight of 491.58 g/mol. Its IUPAC name is bis(cyclopropylmethoxymethanedithiolate);platinum(4+).

Molecular Properties

Compound Namebis(cyclopropylmethoxymethanedithiolate);platinum(4+)
PubChem CID44826214
Molecular FormulaC10H16O2PtS4
Molecular Weight491.58 g/mol
Exact Mass490.97
IUPAC Namebis(cyclopropylmethoxymethanedithiolate);platinum(4+)
SMILES[Pt+4].[S-]C([S-])OCC1CC1.[S-]C([S-])OCC1CC1
InChIInChI=1S/2C5H10OS2.Pt/c2*7-5(8)6-3-4-1-2-4;/h2*4-5,7-8H,1-3H2;/q;;+4/p-4
InChIKeyJRMRYKKKXYVOCN-UHFFFAOYSA-J
XLogP1.58
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500491.58
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

1,4-bis(propan-2-yloxymethyl)cyclohexane
CID 18739268
4-(cyclopropylmethoxy)-N-methylpentan-2-amine
CID 64708927
2-(cyclopropylmethoxy)-3-methylbutan-1-amine
CID 62457455
cyclopropylmethoxymethylcyclopropane;hydron
CID 175036707
4-(cyclopropylmethoxy)pentan-2-one
CID 64697956
2-(cyclopropylmethoxy)-N-ethylbutan-1-amine
CID 62457065
1,4-bis(cyclopropylmethoxy)cyclohexane
CID 147967519
2-(cyclopropylmethoxy)-3-methyl-N-(2-methylpropyl)butan-1-amine
CID 62457054
2-(cyclopropylmethoxy)-3,3-dimethylbutanamide
CID 140911434
(2R)-2-(cyclohexylmethoxy)pentan-3-one
CID 163532136
[(2S,3R)-3-(cyclopropylmethoxy)butan-2-yl] (2S)-2-aminopropanoate
CID 121466683
1-(cyclohexylmethoxy)propan-1-amine
CID 123186405

Frequently Asked Questions

What is the IUPAC name of bis(cyclopropylmethoxymethanedithiolate);platinum(4+)?
The IUPAC name of bis(cyclopropylmethoxymethanedithiolate);platinum(4+) (CID 44826214) is bis(cyclopropylmethoxymethanedithiolate);platinum(4+).
What is the SMILES notation for bis(cyclopropylmethoxymethanedithiolate);platinum(4+)?
The canonical SMILES for bis(cyclopropylmethoxymethanedithiolate);platinum(4+) is [Pt+4].[S-]C([S-])OCC1CC1.[S-]C([S-])OCC1CC1.
What is the InChIKey of bis(cyclopropylmethoxymethanedithiolate);platinum(4+)?
The InChIKey is JRMRYKKKXYVOCN-UHFFFAOYSA-J. The full InChI is InChI=1S/2C5H10OS2.Pt/c2*7-5(8)6-3-4-1-2-4;/h2*4-5,7-8H,1-3H2;/q;;+4/p-4.
What are the key properties of bis(cyclopropylmethoxymethanedithiolate);platinum(4+)?
bis(cyclopropylmethoxymethanedithiolate);platinum(4+) has a molecular weight of 491.58 g/mol, XLogP of 1.58, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(cyclopropylmethoxymethanedithiolate);platinum(4+) is sourced from PubChem (CID 44826214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).