CID 11055752

C16H23FeP+2 — CID 11055752

IUPAC—
SMILESC[C]1[CH][P][CH][C]1C.C[C]1[C](C)[C](C)[C](C)[C]1C.[Fe+2]
InChIInChI=1S/C10H15.C6H8P.Fe/c1-6-7(2)9(4)10(5)8(6)3;1-5-3-7-4-6(5)2;/h1-5H3;3-4H,1-2H3;/q;;+2
InChIKeyXDCOMDZTXIJJMG-UHFFFAOYSA-N
MW302.18 g/mol
LogP5.43
Rot. Bonds

About CID 11055752

CID 11055752 (PubChem CID 11055752) has the molecular formula C16H23FeP+2 and a molecular weight of 302.18 g/mol.

Molecular Properties

Compound NameCID 11055752
PubChem CID11055752
Molecular FormulaC16H23FeP+2
Molecular Weight302.18 g/mol
Exact Mass302.09
IUPAC Name—
SMILESC[C]1[CH][P][CH][C]1C.C[C]1[C](C)[C](C)[C](C)[C]1C.[Fe+2]
InChIInChI=1S/C10H15.C6H8P.Fe/c1-6-7(2)9(4)10(5)8(6)3;1-5-3-7-4-6(5)2;/h1-5H3;3-4H,1-2H3;/q;;+2
InChIKeyXDCOMDZTXIJJMG-UHFFFAOYSA-N
XLogP5.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.18
LogP ≤ 55.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 11055752?
The IUPAC name of CID 11055752 (CID 11055752) is not available.
What is the SMILES notation for CID 11055752?
The canonical SMILES for CID 11055752 is C[C]1[CH][P][CH][C]1C.C[C]1[C](C)[C](C)[C](C)[C]1C.[Fe+2].
What is the InChIKey of CID 11055752?
The InChIKey is XDCOMDZTXIJJMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15.C6H8P.Fe/c1-6-7(2)9(4)10(5)8(6)3;1-5-3-7-4-6(5)2;/h1-5H3;3-4H,1-2H3;/q;;+2.
What are the key properties of CID 11055752?
CID 11055752 has a molecular weight of 302.18 g/mol, XLogP of 5.43, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11055752 is sourced from PubChem (CID 11055752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).