lithium bis(phenylselanyl)methylselanylbenzene

C19H15LiSe3 — CID 12736553

IUPAClithium bis(phenylselanyl)methylselanylbenzene
SMILES[Li+].c1ccc([Se][C-]([Se]c2ccccc2)[Se]c2ccccc2)cc1
InChIInChI=1S/C19H15Se3.Li/c1-4-10-16(11-5-1)20-19(21-17-12-6-2-7-13-17)22-18-14-8-3-9-15-18;/h1-15H;/q-1;+1
InChIKeyDLLVKWFQGFLOJX-UHFFFAOYSA-N
MW487.15 g/mol
LogP-1.47
Rot. Bonds6

About lithium bis(phenylselanyl)methylselanylbenzene

lithium bis(phenylselanyl)methylselanylbenzene (PubChem CID 12736553) has the molecular formula C19H15LiSe3 and a molecular weight of 487.15 g/mol. Its IUPAC name is lithium bis(phenylselanyl)methylselanylbenzene.

Molecular Properties

Compound Namelithium bis(phenylselanyl)methylselanylbenzene
PubChem CID12736553
Molecular FormulaC19H15LiSe3
Molecular Weight487.15 g/mol
Exact Mass489.88
IUPAC Namelithium bis(phenylselanyl)methylselanylbenzene
SMILES[Li+].c1ccc([Se][C-]([Se]c2ccccc2)[Se]c2ccccc2)cc1
InChIInChI=1S/C19H15Se3.Li/c1-4-10-16(11-5-1)20-19(21-17-12-6-2-7-13-17)22-18-14-8-3-9-15-18;/h1-15H;/q-1;+1
InChIKeyDLLVKWFQGFLOJX-UHFFFAOYSA-N
XLogP-1.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500487.15
LogP ≤ 5-1.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

phenylselanylbenzene;dihydrochloride
CID 173104242
phenylselanylbenzene;dihydrochloride
CID 87206847
hydrogen peroxide;(phenyldiselanyl)benzene
CID 161157023
phenyl selenohypochlorite
CID 21928
phenylselanylphosphane
CID 141347501
formaldehyde;phenylselanylbenzene
CID 174430151
methoxyselanylbenzene
CID 12890880
tert-butylselanylbenzene
CID 11171880
dilithium;diphenylmethylbenzene;hydride
CID 173115041
diphenyl(phenylselanyl)phosphane
CID 139265296
2-phenylselanylethene-1,1-diol
CID 11790922
CID 58805500
CID 58805500

Frequently Asked Questions

What is the IUPAC name of lithium bis(phenylselanyl)methylselanylbenzene?
The IUPAC name of lithium bis(phenylselanyl)methylselanylbenzene (CID 12736553) is lithium bis(phenylselanyl)methylselanylbenzene.
What is the SMILES notation for lithium bis(phenylselanyl)methylselanylbenzene?
The canonical SMILES for lithium bis(phenylselanyl)methylselanylbenzene is [Li+].c1ccc([Se][C-]([Se]c2ccccc2)[Se]c2ccccc2)cc1.
What is the InChIKey of lithium bis(phenylselanyl)methylselanylbenzene?
The InChIKey is DLLVKWFQGFLOJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15Se3.Li/c1-4-10-16(11-5-1)20-19(21-17-12-6-2-7-13-17)22-18-14-8-3-9-15-18;/h1-15H;/q-1;+1.
What are the key properties of lithium bis(phenylselanyl)methylselanylbenzene?
lithium bis(phenylselanyl)methylselanylbenzene has a molecular weight of 487.15 g/mol, XLogP of -1.47, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium bis(phenylselanyl)methylselanylbenzene is sourced from PubChem (CID 12736553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).