carbon monoxide;chromium;(R)-cyclohexyl-methyl-phenylphosphane

C16H19CrO3P — CID 134976520

IUPACcarbon monoxide;chromium;(R)-cyclohexyl-methyl-phenylphosphane
SMILESC[P@@](c1ccccc1)C1CCCCC1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr]
InChIInChI=1S/C13H19P.3CO.Cr/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;3*1-2;/h2,4-5,8-9,13H,3,6-7,10-11H2,1H3;;;;/t14-;;;;/m0..../s1
InChIKeyPUXPGMOTHMVLDI-XCYGSCDUSA-N
MW342.30 g/mol
LogP3.64
Rot. Bonds2

About carbon monoxide;chromium;(R)-cyclohexyl-methyl-phenylphosphane

carbon monoxide;chromium;(R)-cyclohexyl-methyl-phenylphosphane (PubChem CID 134976520) has the molecular formula C16H19CrO3P and a molecular weight of 342.30 g/mol. Its IUPAC name is carbon monoxide;chromium;(R)-cyclohexyl-methyl-phenylphosphane.

Molecular Properties

Compound Namecarbon monoxide;chromium;(R)-cyclohexyl-methyl-phenylphosphane
PubChem CID134976520
Molecular FormulaC16H19CrO3P
Molecular Weight342.30 g/mol
Exact Mass342.05
IUPAC Namecarbon monoxide;chromium;(R)-cyclohexyl-methyl-phenylphosphane
SMILESC[P@@](c1ccccc1)C1CCCCC1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr]
InChIInChI=1S/C13H19P.3CO.Cr/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;3*1-2;/h2,4-5,8-9,13H,3,6-7,10-11H2,1H3;;;;/t14-;;;;/m0..../s1
InChIKeyPUXPGMOTHMVLDI-XCYGSCDUSA-N
XLogP3.64
TPSA59.70 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.30
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of carbon monoxide;chromium;(R)-cyclohexyl-methyl-phenylphosphane?
The IUPAC name of carbon monoxide;chromium;(R)-cyclohexyl-methyl-phenylphosphane (CID 134976520) is carbon monoxide;chromium;(R)-cyclohexyl-methyl-phenylphosphane.
What is the SMILES notation for carbon monoxide;chromium;(R)-cyclohexyl-methyl-phenylphosphane?
The canonical SMILES for carbon monoxide;chromium;(R)-cyclohexyl-methyl-phenylphosphane is C[P@@](c1ccccc1)C1CCCCC1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr].
What is the InChIKey of carbon monoxide;chromium;(R)-cyclohexyl-methyl-phenylphosphane?
The InChIKey is PUXPGMOTHMVLDI-XCYGSCDUSA-N. The full InChI is InChI=1S/C13H19P.3CO.Cr/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13;3*1-2;/h2,4-5,8-9,13H,3,6-7,10-11H2,1H3;;;;/t14-;;;;/m0..../s1.
What are the key properties of carbon monoxide;chromium;(R)-cyclohexyl-methyl-phenylphosphane?
carbon monoxide;chromium;(R)-cyclohexyl-methyl-phenylphosphane has a molecular weight of 342.30 g/mol, XLogP of 3.64, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbon monoxide;chromium;(R)-cyclohexyl-methyl-phenylphosphane is sourced from PubChem (CID 134976520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).