cobalt;1H-inden-1-ylmethanone

C10H7CoO- — CID 150174456

IUPACcobalt;1H-inden-1-ylmethanone
SMILESO=[C-]C1C=Cc2ccccc21.[Co]
InChIInChI=1S/C10H7O.Co/c11-7-9-6-5-8-3-1-2-4-10(8)9;/h1-6,9H;/q-1;
InChIKeyVOAWDZZUDNWGKJ-UHFFFAOYSA-N
MW202.10 g/mol
LogP1.90
Rot. Bonds1

About cobalt;1H-inden-1-ylmethanone

cobalt;1H-inden-1-ylmethanone (PubChem CID 150174456) has the molecular formula C10H7CoO- and a molecular weight of 202.10 g/mol. Its IUPAC name is cobalt;1H-inden-1-ylmethanone.

Molecular Properties

Compound Namecobalt;1H-inden-1-ylmethanone
PubChem CID150174456
Molecular FormulaC10H7CoO-
Molecular Weight202.10 g/mol
Exact Mass201.98
IUPAC Namecobalt;1H-inden-1-ylmethanone
SMILESO=[C-]C1C=Cc2ccccc21.[Co]
InChIInChI=1S/C10H7O.Co/c11-7-9-6-5-8-3-1-2-4-10(8)9;/h1-6,9H;/q-1;
InChIKeyVOAWDZZUDNWGKJ-UHFFFAOYSA-N
XLogP1.90
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.10
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cobalt;1H-inden-1-ylmethanone?
The IUPAC name of cobalt;1H-inden-1-ylmethanone (CID 150174456) is cobalt;1H-inden-1-ylmethanone.
What is the SMILES notation for cobalt;1H-inden-1-ylmethanone?
The canonical SMILES for cobalt;1H-inden-1-ylmethanone is O=[C-]C1C=Cc2ccccc21.[Co].
What is the InChIKey of cobalt;1H-inden-1-ylmethanone?
The InChIKey is VOAWDZZUDNWGKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7O.Co/c11-7-9-6-5-8-3-1-2-4-10(8)9;/h1-6,9H;/q-1;.
What are the key properties of cobalt;1H-inden-1-ylmethanone?
cobalt;1H-inden-1-ylmethanone has a molecular weight of 202.10 g/mol, XLogP of 1.90, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt;1H-inden-1-ylmethanone is sourced from PubChem (CID 150174456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).