butane-1-thiol;silane

C4H14SSi — CID 157290532

IUPACbutane-1-thiol;silane
SMILESCCCCS.[SiH4]
InChIInChI=1S/C4H10S.H4Si/c1-2-3-4-5;/h5H,2-4H2,1H3;1H4
InChIKeyBATCLJIVOYAPJP-UHFFFAOYSA-N
MW122.31 g/mol
LogP0.26
Rot. Bonds2

About butane-1-thiol;silane

butane-1-thiol;silane (PubChem CID 157290532) has the molecular formula C4H14SSi and a molecular weight of 122.31 g/mol. Its IUPAC name is butane-1-thiol;silane.

Molecular Properties

Compound Namebutane-1-thiol;silane
PubChem CID157290532
Molecular FormulaC4H14SSi
Molecular Weight122.31 g/mol
Exact Mass122.06
IUPAC Namebutane-1-thiol;silane
SMILESCCCCS.[SiH4]
InChIInChI=1S/C4H10S.H4Si/c1-2-3-4-5;/h5H,2-4H2,1H3;1H4
InChIKeyBATCLJIVOYAPJP-UHFFFAOYSA-N
XLogP0.26
TPSA0.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.31
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

butane-1-thiol;hydrofluoride
CID 161154336
decane-1-thiol
CID 8917
octadecane-1-thiol;octane-1-thiol
CID 158706451
bis(pentane-1-thiol);zinc
CID 87496779
decane-1-thiol;undecane-1-thiol
CID 174806736
dodecane-1-thiol
CID 8195
cobalt;dodecane-1-thiol
CID 158588427
iron;octane-1-thiol
CID 174785470
CID 160700659
CID 160700659
bis(octadecane-1-thiol);zinc
CID 87094547
bis(dodecane-1-thiol);zinc
CID 87094417
dodecane-1-thiol;palladium
CID 174472866

Frequently Asked Questions

What is the IUPAC name of butane-1-thiol;silane?
The IUPAC name of butane-1-thiol;silane (CID 157290532) is butane-1-thiol;silane.
What is the SMILES notation for butane-1-thiol;silane?
The canonical SMILES for butane-1-thiol;silane is CCCCS.[SiH4].
What is the InChIKey of butane-1-thiol;silane?
The InChIKey is BATCLJIVOYAPJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10S.H4Si/c1-2-3-4-5;/h5H,2-4H2,1H3;1H4.
What are the key properties of butane-1-thiol;silane?
butane-1-thiol;silane has a molecular weight of 122.31 g/mol, XLogP of 0.26, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butane-1-thiol;silane is sourced from PubChem (CID 157290532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).