[[[bis(sulfanylidene)-λ6-sulfanylidene]-sulfanylidene-λ6-sulfanylidene]-λ4-sulfanylidene]-propylborane

C3H7BS6 — CID 89371159

IUPAC[[[bis(sulfanylidene)-λ6-sulfanylidene]-sulfanylidene-λ6-sulfanylidene]-λ4-sulfanylidene]-propylborane
SMILESCCCB=S=S(=S)=S(=S)=S
InChIInChI=1S/C3H7BS6/c1-2-3-4-8-10(7)9(5)6/h2-3H2,1H3
InChIKeyMOVUGILQMALASM-UHFFFAOYSA-N
MW246.30 g/mol
LogP0.97
Rot. Bonds2

About [[[bis(sulfanylidene)-λ6-sulfanylidene]-sulfanylidene-λ6-sulfanylidene]-λ4-sulfanylidene]-propylborane

[[[bis(sulfanylidene)-λ6-sulfanylidene]-sulfanylidene-λ6-sulfanylidene]-λ4-sulfanylidene]-propylborane (PubChem CID 89371159) has the molecular formula C3H7BS6 and a molecular weight of 246.30 g/mol. Its IUPAC name is [[[bis(sulfanylidene)-λ6-sulfanylidene]-sulfanylidene-λ6-sulfanylidene]-λ4-sulfanylidene]-propylborane.

Molecular Properties

Compound Name[[[bis(sulfanylidene)-λ6-sulfanylidene]-sulfanylidene-λ6-sulfanylidene]-λ4-sulfanylidene]-propylborane
PubChem CID89371159
Molecular FormulaC3H7BS6
Molecular Weight246.30 g/mol
Exact Mass245.90
IUPAC Name[[[bis(sulfanylidene)-λ6-sulfanylidene]-sulfanylidene-λ6-sulfanylidene]-λ4-sulfanylidene]-propylborane
SMILESCCCB=S=S(=S)=S(=S)=S
InChIInChI=1S/C3H7BS6/c1-2-3-4-8-10(7)9(5)6/h2-3H2,1H3
InChIKeyMOVUGILQMALASM-UHFFFAOYSA-N
XLogP0.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.30
LogP ≤ 50.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

CID 87867329
CID 87867329
CID 159809580
CID 159809580
propan-2-yloxy-propyl-sulfanylidene-λ4-sulfane
CID 57354437
methane;methylidene(propyl)borane
CID 157160485
ethylsulfinothioylmethanethiol
CID 118518085
propan-2-yl propane-1-sulfinate
CID 23271047
butylsulfanyloxymethanethiol
CID 139474645
methoxymethane;tris(propan-1-ol)
CID 174760877
ethyl-iodo-sulfanylidene-λ4-sulfane
CID 89315007
methoxymethane;bis(propan-1-ol)
CID 137366988
[ethyl(sulfanylidene)-λ6-sulfanylidyne]borane
CID 89345371
ethanethiol;methyl(sulfanylidene)borane
CID 90969784

Frequently Asked Questions

What is the IUPAC name of [[[bis(sulfanylidene)-λ6-sulfanylidene]-sulfanylidene-λ6-sulfanylidene]-λ4-sulfanylidene]-propylborane?
The IUPAC name of [[[bis(sulfanylidene)-λ6-sulfanylidene]-sulfanylidene-λ6-sulfanylidene]-λ4-sulfanylidene]-propylborane (CID 89371159) is [[[bis(sulfanylidene)-λ6-sulfanylidene]-sulfanylidene-λ6-sulfanylidene]-λ4-sulfanylidene]-propylborane.
What is the SMILES notation for [[[bis(sulfanylidene)-λ6-sulfanylidene]-sulfanylidene-λ6-sulfanylidene]-λ4-sulfanylidene]-propylborane?
The canonical SMILES for [[[bis(sulfanylidene)-λ6-sulfanylidene]-sulfanylidene-λ6-sulfanylidene]-λ4-sulfanylidene]-propylborane is CCCB=S=S(=S)=S(=S)=S.
What is the InChIKey of [[[bis(sulfanylidene)-λ6-sulfanylidene]-sulfanylidene-λ6-sulfanylidene]-λ4-sulfanylidene]-propylborane?
The InChIKey is MOVUGILQMALASM-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7BS6/c1-2-3-4-8-10(7)9(5)6/h2-3H2,1H3.
What are the key properties of [[[bis(sulfanylidene)-λ6-sulfanylidene]-sulfanylidene-λ6-sulfanylidene]-λ4-sulfanylidene]-propylborane?
[[[bis(sulfanylidene)-λ6-sulfanylidene]-sulfanylidene-λ6-sulfanylidene]-λ4-sulfanylidene]-propylborane has a molecular weight of 246.30 g/mol, XLogP of 0.97, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [[[bis(sulfanylidene)-λ6-sulfanylidene]-sulfanylidene-λ6-sulfanylidene]-λ4-sulfanylidene]-propylborane is sourced from PubChem (CID 89371159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).