CID 134992417

C13H24PRu — CID 134992417

IUPAC—
SMILESCP(C)C.C[C]1C(C)=C(C)C(C)=C1C.[Ru]
InChIInChI=1S/C10H15.C3H9P.Ru/c1-6-7(2)9(4)10(5)8(6)3;1-4(2)3;/h1-5H3;1-3H3;
InChIKeyMXLCAGDJNTVJOW-UHFFFAOYSA-N
MW312.38 g/mol
LogP4.62
Rot. Bonds

About CID 134992417

CID 134992417 (PubChem CID 134992417) has the molecular formula C13H24PRu and a molecular weight of 312.38 g/mol.

Molecular Properties

Compound NameCID 134992417
PubChem CID134992417
Molecular FormulaC13H24PRu
Molecular Weight312.38 g/mol
Exact Mass313.07
IUPAC Name—
SMILESCP(C)C.C[C]1C(C)=C(C)C(C)=C1C.[Ru]
InChIInChI=1S/C10H15.C3H9P.Ru/c1-6-7(2)9(4)10(5)8(6)3;1-4(2)3;/h1-5H3;1-3H3;
InChIKeyMXLCAGDJNTVJOW-UHFFFAOYSA-N
XLogP4.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.38
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 134992417?
The IUPAC name of CID 134992417 (CID 134992417) is not available.
What is the SMILES notation for CID 134992417?
The canonical SMILES for CID 134992417 is CP(C)C.C[C]1C(C)=C(C)C(C)=C1C.[Ru].
What is the InChIKey of CID 134992417?
The InChIKey is MXLCAGDJNTVJOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15.C3H9P.Ru/c1-6-7(2)9(4)10(5)8(6)3;1-4(2)3;/h1-5H3;1-3H3;.
What are the key properties of CID 134992417?
CID 134992417 has a molecular weight of 312.38 g/mol, XLogP of 4.62, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134992417 is sourced from PubChem (CID 134992417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).