butane;sulfane

C8H22S — CID 162203569

IUPACbutane;sulfane
SMILESCCCC.CCCC.S
InChIInChI=1S/2C4H10.H2S/c2*1-3-4-2;/h2*3-4H2,1-2H3;1H2
InChIKeyVTNZIXLOWXYYGA-UHFFFAOYSA-N
MW150.33 g/mol
LogP3.73
Rot. Bonds2

About butane;sulfane

butane;sulfane (PubChem CID 162203569) has the molecular formula C8H22S and a molecular weight of 150.33 g/mol. Its IUPAC name is butane;sulfane.

Molecular Properties

Compound Namebutane;sulfane
PubChem CID162203569
Molecular FormulaC8H22S
Molecular Weight150.33 g/mol
Exact Mass150.14
IUPAC Namebutane;sulfane
SMILESCCCC.CCCC.S
InChIInChI=1S/2C4H10.H2S/c2*1-3-4-2;/h2*3-4H2,1-2H3;1H2
InChIKeyVTNZIXLOWXYYGA-UHFFFAOYSA-N
XLogP3.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.33
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

butane;sulfane;hydrochloride
CID 173081400
butane;dihydrochloride
CID 19855579
azane;butane
CID 18518846
butane;methane
CID 169432073
butane;dihydroiodide
CID 173299742
butane;octahydrofluoride
CID 173254735
butane;neodymium
CID 173047512
butane;dihydrochloride
CID 175321374
butane;manganese
CID 173124338
butane;lanthanum
CID 174455562
butane;methane
CID 158764755
butane;hydrazine
CID 161056989

Frequently Asked Questions

What is the IUPAC name of butane;sulfane?
The IUPAC name of butane;sulfane (CID 162203569) is butane;sulfane.
What is the SMILES notation for butane;sulfane?
The canonical SMILES for butane;sulfane is CCCC.CCCC.S.
What is the InChIKey of butane;sulfane?
The InChIKey is VTNZIXLOWXYYGA-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H10.H2S/c2*1-3-4-2;/h2*3-4H2,1-2H3;1H2.
What are the key properties of butane;sulfane?
butane;sulfane has a molecular weight of 150.33 g/mol, XLogP of 3.73, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butane;sulfane is sourced from PubChem (CID 162203569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).