CID 11023914

C16H18Co2- — CID 11023914

IUPAC—
SMILESC=C[CH][CH][C-]C.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Co].[Co]
InChIInChI=1S/C6H8.2C5H5.2Co/c1-3-5-6-4-2;2*1-2-4-5-3-1;;/h3,5-6H,1H2,2H3;2*1-5H;;/q-1;;;;
InChIKeyQMXWAPZFMZBBMX-UHFFFAOYSA-N
MW328.19 g/mol
LogP3.72
Rot. Bonds3

About CID 11023914

CID 11023914 (PubChem CID 11023914) has the molecular formula C16H18Co2- and a molecular weight of 328.19 g/mol.

Molecular Properties

Compound NameCID 11023914
PubChem CID11023914
Molecular FormulaC16H18Co2-
Molecular Weight328.19 g/mol
Exact Mass328.01
IUPAC Name—
SMILESC=C[CH][CH][C-]C.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Co].[Co]
InChIInChI=1S/C6H8.2C5H5.2Co/c1-3-5-6-4-2;2*1-2-4-5-3-1;;/h3,5-6H,1H2,2H3;2*1-5H;;/q-1;;;;
InChIKeyQMXWAPZFMZBBMX-UHFFFAOYSA-N
XLogP3.72
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.19
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of CID 11023914?
The IUPAC name of CID 11023914 (CID 11023914) is not available.
What is the SMILES notation for CID 11023914?
The canonical SMILES for CID 11023914 is C=C[CH][CH][C-]C.[CH]1[CH][CH][CH][CH]1.[CH]1[CH][CH][CH][CH]1.[Co].[Co].
What is the InChIKey of CID 11023914?
The InChIKey is QMXWAPZFMZBBMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8.2C5H5.2Co/c1-3-5-6-4-2;2*1-2-4-5-3-1;;/h3,5-6H,1H2,2H3;2*1-5H;;/q-1;;;;.
What are the key properties of CID 11023914?
CID 11023914 has a molecular weight of 328.19 g/mol, XLogP of 3.72, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11023914 is sourced from PubChem (CID 11023914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).