disilver;dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;bis(9-ethynylphenanthrene)

C58H68Ag2P2+2 — CID 162499411

IUPACdisilver;dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;bis(9-ethynylphenanthrene)
SMILESC1CCC([PH+](CC[PH+](C2CCCCC2)C2CCCCC2)C2CCCCC2)CC1.[Ag+].[Ag+].[C-]#Cc1cc2ccccc2c2ccccc12.[C-]#Cc1cc2ccccc2c2ccccc12
InChIInChI=1S/C26H48P2.2C16H9.2Ag/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;2*1-2-12-11-13-7-3-4-9-15(13)16-10-6-5-8-14(12)16;;/h23-26H,1-22H2;2*3-11H;;/q;2*-1;2*+1/p+2
InChIKeyYHWGZKJSHJFNMB-UHFFFAOYSA-P
MW1042.87 g/mol
LogP16.60
Rot. Bonds7

About disilver;dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;bis(9-ethynylphenanthrene)

disilver;dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;bis(9-ethynylphenanthrene) (PubChem CID 162499411) has the molecular formula C58H68Ag2P2+2 and a molecular weight of 1042.87 g/mol. Its IUPAC name is disilver;dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;bis(9-ethynylphenanthrene).

Molecular Properties

Compound Namedisilver;dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;bis(9-ethynylphenanthrene)
PubChem CID162499411
Molecular FormulaC58H68Ag2P2+2
Molecular Weight1042.87 g/mol
Exact Mass1040.29
IUPAC Namedisilver;dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;bis(9-ethynylphenanthrene)
SMILESC1CCC([PH+](CC[PH+](C2CCCCC2)C2CCCCC2)C2CCCCC2)CC1.[Ag+].[Ag+].[C-]#Cc1cc2ccccc2c2ccccc12.[C-]#Cc1cc2ccccc2c2ccccc12
InChIInChI=1S/C26H48P2.2C16H9.2Ag/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;2*1-2-12-11-13-7-3-4-9-15(13)16-10-6-5-8-14(12)16;;/h23-26H,1-22H2;2*3-11H;;/q;2*-1;2*+1/p+2
InChIKeyYHWGZKJSHJFNMB-UHFFFAOYSA-P
XLogP16.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001042.87
LogP ≤ 516.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;bis(9-ethynylphenanthrene);bis(gold(1+))
CID 162499882
silver;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;bis(9-ethynylphenanthrene);gold(1+)
CID 162499383
hexasilver;2-bis(2-methylphenyl)phosphaniumylethyl-bis(2-methylphenyl)phosphanium;dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;2-dimethylphosphaniumylethyl(diphenyl)phosphanium;hexakis(9-ethynylanthracene)
CID 163814394
disilver;diphenylphosphaniumylmethyl(diphenyl)phosphanium;1-ethynylphenanthrene;9-ethynylphenanthrene
CID 162499694
(2-diphenylphosphaniumylphenyl)-diphenylphosphanium;6-ethynylchrysene;9-ethynylphenanthrene;bis(gold(1+))
CID 162499487
dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;bis(2-ethynyl-9H-fluorene);bis(gold(1+))
CID 164790311
disilver;2-dimethylphosphaniumylethyl(dimethyl)phosphanium;bis(9-ethynylanthracene)
CID 162499606
silver 1-ethynylnaphthalene
CID 15597420
(3-diphenylphosphaniumyl-5,6,7,8-tetrahydronaphthalen-2-yl)-diphenylphosphanium;bis(6-ethynylchrysene);bis(gold(1+))
CID 162499417
9-[2-(cyclohexen-1-yl)ethynyl]phenanthrene
CID 102411203
hexasilver;tris(2-diphenylphosphaniumylethyl(diphenyl)phosphanium);bis(1-ethynylchrysene);bis(2-ethynylchrysene);bis(5-ethynylchrysene)
CID 163797382
hexasilver;[2-bis(2-methylphenyl)phosphaniumylphenyl]-bis(2-methylphenyl)phosphanium;dicyclohexyl-(2-dicyclohexylphosphaniumylphenyl)phosphanium;[2-di(propan-2-yl)phosphaniumylphenyl]-di(propan-2-yl)phosphanium;hexakis(9-ethynylanthracene)
CID 163904319

Frequently Asked Questions

What is the IUPAC name of disilver;dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;bis(9-ethynylphenanthrene)?
The IUPAC name of disilver;dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;bis(9-ethynylphenanthrene) (CID 162499411) is disilver;dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;bis(9-ethynylphenanthrene).
What is the SMILES notation for disilver;dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;bis(9-ethynylphenanthrene)?
The canonical SMILES for disilver;dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;bis(9-ethynylphenanthrene) is C1CCC([PH+](CC[PH+](C2CCCCC2)C2CCCCC2)C2CCCCC2)CC1.[Ag+].[Ag+].[C-]#Cc1cc2ccccc2c2ccccc12.[C-]#Cc1cc2ccccc2c2ccccc12.
What is the InChIKey of disilver;dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;bis(9-ethynylphenanthrene)?
The InChIKey is YHWGZKJSHJFNMB-UHFFFAOYSA-P. The full InChI is InChI=1S/C26H48P2.2C16H9.2Ag/c1-5-13-23(14-6-1)27(24-15-7-2-8-16-24)21-22-28(25-17-9-3-10-18-25)26-19-11-4-12-20-26;2*1-2-12-11-13-7-3-4-9-15(13)16-10-6-5-8-14(12)16;;/h23-26H,1-22H2;2*3-11H;;/q;2*-1;2*+1/p+2.
What are the key properties of disilver;dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;bis(9-ethynylphenanthrene)?
disilver;dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;bis(9-ethynylphenanthrene) has a molecular weight of 1042.87 g/mol, XLogP of 16.60, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for disilver;dicyclohexyl(2-dicyclohexylphosphaniumylethyl)phosphanium;bis(9-ethynylphenanthrene) is sourced from PubChem (CID 162499411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).