bromo-diphenyl-sulfanylidene-λ5-phosphane

C12H10BrPS — CID 23415811

IUPACbromo-diphenyl-sulfanylidene-λ5-phosphane
SMILESS=P(Br)(c1ccccc1)c1ccccc1
InChIInChI=1S/C12H10BrPS/c13-14(15,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
InChIKeyVAEYYBHMZVCMFO-UHFFFAOYSA-N
MW297.16 g/mol
LogP3.43
Rot. Bonds2

About bromo-diphenyl-sulfanylidene-λ5-phosphane

bromo-diphenyl-sulfanylidene-λ5-phosphane (PubChem CID 23415811) has the molecular formula C12H10BrPS and a molecular weight of 297.16 g/mol. Its IUPAC name is bromo-diphenyl-sulfanylidene-λ5-phosphane.

Molecular Properties

Compound Namebromo-diphenyl-sulfanylidene-λ5-phosphane
PubChem CID23415811
Molecular FormulaC12H10BrPS
Molecular Weight297.16 g/mol
Exact Mass295.94
IUPAC Namebromo-diphenyl-sulfanylidene-λ5-phosphane
SMILESS=P(Br)(c1ccccc1)c1ccccc1
InChIInChI=1S/C12H10BrPS/c13-14(15,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
InChIKeyVAEYYBHMZVCMFO-UHFFFAOYSA-N
XLogP3.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.16
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Diphenylselenothiophosphinic acid
CID 11243432
oxido-diphenyl-sulfanylidene-λ5-phosphane
CID 3382215
hydroxy-diphenyl-sulfanylidene-λ5-phosphane;hydrochloride
CID 172809471
dimethyl-phenyl-sulfanylidene-λ5-phosphane;ethane
CID 91466135
methyl-phenyl-sulfanyl-sulfanylidene-lambda5-phosphane
CID 586594
diphenylphosphorylbenzene;terbium
CID 86595283
diphenylphosphinothioyl(phenyl)methanone
CID 54293875
diphenyl-(2-phenylethynyl)-sulfanylidene-λ5-phosphane
CID 23418911
bis(chloromethyl)-phenyl-sulfanylidene-λ5-phosphane
CID 23415957
chloromethyl-diphenyl-sulfanylidene-λ5-phosphane
CID 161049975
phenoxy-diphenyl-sulfanylidene-lambda5-phosphane
CID 13410918
methoxy-methyl-phenyl-sulfanylidene-λ5-phosphane
CID 12650712

Frequently Asked Questions

What is the IUPAC name of bromo-diphenyl-sulfanylidene-λ5-phosphane?
The IUPAC name of bromo-diphenyl-sulfanylidene-λ5-phosphane (CID 23415811) is bromo-diphenyl-sulfanylidene-λ5-phosphane.
What is the SMILES notation for bromo-diphenyl-sulfanylidene-λ5-phosphane?
The canonical SMILES for bromo-diphenyl-sulfanylidene-λ5-phosphane is S=P(Br)(c1ccccc1)c1ccccc1.
What is the InChIKey of bromo-diphenyl-sulfanylidene-λ5-phosphane?
The InChIKey is VAEYYBHMZVCMFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrPS/c13-14(15,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H.
What are the key properties of bromo-diphenyl-sulfanylidene-λ5-phosphane?
bromo-diphenyl-sulfanylidene-λ5-phosphane has a molecular weight of 297.16 g/mol, XLogP of 3.43, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bromo-diphenyl-sulfanylidene-λ5-phosphane is sourced from PubChem (CID 23415811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).