methane;prop-1-ene;sulfane

C4H20S5 — CID 20979358

IUPACmethane;prop-1-ene;sulfane
SMILESC.C=CC.S.S.S.S.S
InChIInChI=1S/C3H6.CH4.5H2S/c1-3-2;;;;;;/h3H,1H2,2H3;1H4;5*1H2
InChIKeyGBPMWSVUKZNQKA-UHFFFAOYSA-N
MW228.54 g/mol
LogP2.39
Rot. Bonds

About methane;prop-1-ene;sulfane

methane;prop-1-ene;sulfane (PubChem CID 20979358) has the molecular formula C4H20S5 and a molecular weight of 228.54 g/mol. Its IUPAC name is methane;prop-1-ene;sulfane.

Molecular Properties

Compound Namemethane;prop-1-ene;sulfane
PubChem CID20979358
Molecular FormulaC4H20S5
Molecular Weight228.54 g/mol
Exact Mass228.02
IUPAC Namemethane;prop-1-ene;sulfane
SMILESC.C=CC.S.S.S.S.S
InChIInChI=1S/C3H6.CH4.5H2S/c1-3-2;;;;;;/h3H,1H2,2H3;1H4;5*1H2
InChIKeyGBPMWSVUKZNQKA-UHFFFAOYSA-N
XLogP2.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.54
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

ethane;methane;bis(prop-1-ene)
CID 159459488
prop-1-ene
CID 162178440
ethane;tetrakis(prop-1-ene)
CID 90918926
ethene;tetrakis(prop-1-ene)
CID 158667737
λ2-plumbane;prop-1-ene
CID 173103273
ethane;bis(prop-1-ene)
CID 91426438
azane;tris(prop-1-ene)
CID 162019717
azane;tris(prop-1-ene)
CID 173323353
bis(prop-1-ene);hydrate
CID 21257591
prop-1-ene;hydrochloride
CID 19097823
buta-1,3-diene;ethane;methane;prop-1-ene
CID 142056054
ethylideneazanium;methane;prop-1-ene
CID 158715679

Frequently Asked Questions

What is the IUPAC name of methane;prop-1-ene;sulfane?
The IUPAC name of methane;prop-1-ene;sulfane (CID 20979358) is methane;prop-1-ene;sulfane.
What is the SMILES notation for methane;prop-1-ene;sulfane?
The canonical SMILES for methane;prop-1-ene;sulfane is C.C=CC.S.S.S.S.S.
What is the InChIKey of methane;prop-1-ene;sulfane?
The InChIKey is GBPMWSVUKZNQKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6.CH4.5H2S/c1-3-2;;;;;;/h3H,1H2,2H3;1H4;5*1H2.
What are the key properties of methane;prop-1-ene;sulfane?
methane;prop-1-ene;sulfane has a molecular weight of 228.54 g/mol, XLogP of 2.39, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methane;prop-1-ene;sulfane is sourced from PubChem (CID 20979358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).