cyclopenta-1,3-diene;bis(methyl(diphenyl)phosphanium);osmium monohydride

C31H33OsP2+ — CID 11987429

IUPACcyclopenta-1,3-diene;bis(methyl(diphenyl)phosphanium);osmium monohydride
SMILESC[PH+](c1ccccc1)c1ccccc1.C[PH+](c1ccccc1)c1ccccc1.[Os].c1cc[cH-]c1
InChIInChI=1S/2C13H13P.C5H5.Os/c2*1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;1-2-4-5-3-1;/h2*2-11H,1H3;1-5H;/q;;-1;/p+2
InChIKeyHGXKFBBKYNDHKV-UHFFFAOYSA-P
MW657.78 g/mol
LogP6.37
Rot. Bonds4

About cyclopenta-1,3-diene;bis(methyl(diphenyl)phosphanium);osmium monohydride

cyclopenta-1,3-diene;bis(methyl(diphenyl)phosphanium);osmium monohydride (PubChem CID 11987429) has the molecular formula C31H33OsP2+ and a molecular weight of 657.78 g/mol. Its IUPAC name is cyclopenta-1,3-diene;bis(methyl(diphenyl)phosphanium);osmium monohydride.

Molecular Properties

Compound Namecyclopenta-1,3-diene;bis(methyl(diphenyl)phosphanium);osmium monohydride
PubChem CID11987429
Molecular FormulaC31H33OsP2+
Molecular Weight657.78 g/mol
Exact Mass659.17
IUPAC Namecyclopenta-1,3-diene;bis(methyl(diphenyl)phosphanium);osmium monohydride
SMILESC[PH+](c1ccccc1)c1ccccc1.C[PH+](c1ccccc1)c1ccccc1.[Os].c1cc[cH-]c1
InChIInChI=1S/2C13H13P.C5H5.Os/c2*1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;1-2-4-5-3-1;/h2*2-11H,1H3;1-5H;/q;;-1;/p+2
InChIKeyHGXKFBBKYNDHKV-UHFFFAOYSA-P
XLogP6.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500657.78
LogP ≤ 56.37
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'}

Analyze cyclopenta-1,3-diene;bis(methyl(diphenyl)phosphanium);osmium monohydride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cyclopenta-1,3-diene;iron(6+);bis(methyl(diphenyl)phosphanium);cyanide
CID 11985301
carbanide;gold(3+);methyl(diphenyl)phosphanium
CID 6327558
bis(methyl(diphenyl)phosphanium);trichlorovanadium
CID 140811308
carbon monoxide;cyclopenta-1,3-diene;iron(6+);propane;triphenylphosphanium
CID 172991193
cyclopenta-1,3-diene;2-diphenylphosphaniumylethyl(diphenyl)phosphanium;ethene;iron(6+)
CID 11987308
dimethyl(phenyl)phosphanium
CID 23415341
cyclopenta-1,3-diene;cyclopentane;tetrakis(ethane-1,1-diol);ruthenium;bis(ruthenium(6+));tetrakis(triphenylphosphanium);dicyanide
CID 11985471
carbon monoxide;cyclopenta-1,3-diene;iron;propan-1-one;triphenylphosphanium
CID 42622038
CID 161097193
CID 161097193
chromium(4+);bis(cyclopenta-1,3-diene);dichloride
CID 158887640
azanide;chromium(4+);bis(cyclopenta-1,3-diene)
CID 175973666
cyclopenta-1,3-diene;3,3-diphenylpropa-1,2-dienylideneruthenium(1+);bis(trimethylphosphanium)
CID 11985827

Frequently Asked Questions

What is the IUPAC name of cyclopenta-1,3-diene;bis(methyl(diphenyl)phosphanium);osmium monohydride?
The IUPAC name of cyclopenta-1,3-diene;bis(methyl(diphenyl)phosphanium);osmium monohydride (CID 11987429) is cyclopenta-1,3-diene;bis(methyl(diphenyl)phosphanium);osmium monohydride.
What is the SMILES notation for cyclopenta-1,3-diene;bis(methyl(diphenyl)phosphanium);osmium monohydride?
The canonical SMILES for cyclopenta-1,3-diene;bis(methyl(diphenyl)phosphanium);osmium monohydride is C[PH+](c1ccccc1)c1ccccc1.C[PH+](c1ccccc1)c1ccccc1.[Os].c1cc[cH-]c1.
What is the InChIKey of cyclopenta-1,3-diene;bis(methyl(diphenyl)phosphanium);osmium monohydride?
The InChIKey is HGXKFBBKYNDHKV-UHFFFAOYSA-P. The full InChI is InChI=1S/2C13H13P.C5H5.Os/c2*1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;1-2-4-5-3-1;/h2*2-11H,1H3;1-5H;/q;;-1;/p+2.
What are the key properties of cyclopenta-1,3-diene;bis(methyl(diphenyl)phosphanium);osmium monohydride?
cyclopenta-1,3-diene;bis(methyl(diphenyl)phosphanium);osmium monohydride has a molecular weight of 657.78 g/mol, XLogP of 6.37, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta-1,3-diene;bis(methyl(diphenyl)phosphanium);osmium monohydride is sourced from PubChem (CID 11987429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).