cobalt;cyclopenta-2,4-dien-1-yl(diethyl)phosphane;cyclopentane

C14H19CoP-6 — CID 174798718

IUPACcobalt;cyclopenta-2,4-dien-1-yl(diethyl)phosphane;cyclopentane
SMILESCCP(CC)[c-]1cccc1.[Co].[cH-]1[cH-][cH-][cH-][cH-]1
InChIInChI=1S/C9H14P.C5H5.Co/c1-3-10(4-2)9-7-5-6-8-9;1-2-4-5-3-1;/h5-8H,3-4H2,1-2H3;1-5H;/q-1;-5;
InChIKeyHQWIXFFGEYLUEH-UHFFFAOYSA-N
MW277.21 g/mol
LogP3.96
Rot. Bonds3

About cobalt;cyclopenta-2,4-dien-1-yl(diethyl)phosphane;cyclopentane

cobalt;cyclopenta-2,4-dien-1-yl(diethyl)phosphane;cyclopentane (PubChem CID 174798718) has the molecular formula C14H19CoP-6 and a molecular weight of 277.21 g/mol. Its IUPAC name is cobalt;cyclopenta-2,4-dien-1-yl(diethyl)phosphane;cyclopentane.

Molecular Properties

Compound Namecobalt;cyclopenta-2,4-dien-1-yl(diethyl)phosphane;cyclopentane
PubChem CID174798718
Molecular FormulaC14H19CoP-6
Molecular Weight277.21 g/mol
Exact Mass277.06
IUPAC Namecobalt;cyclopenta-2,4-dien-1-yl(diethyl)phosphane;cyclopentane
SMILESCCP(CC)[c-]1cccc1.[Co].[cH-]1[cH-][cH-][cH-][cH-]1
InChIInChI=1S/C9H14P.C5H5.Co/c1-3-10(4-2)9-7-5-6-8-9;1-2-4-5-3-1;/h5-8H,3-4H2,1-2H3;1-5H;/q-1;-5;
InChIKeyHQWIXFFGEYLUEH-UHFFFAOYSA-N
XLogP3.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.21
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cobalt;cyclopenta-2,4-dien-1-yl(diethyl)phosphane;cyclopentane?
The IUPAC name of cobalt;cyclopenta-2,4-dien-1-yl(diethyl)phosphane;cyclopentane (CID 174798718) is cobalt;cyclopenta-2,4-dien-1-yl(diethyl)phosphane;cyclopentane.
What is the SMILES notation for cobalt;cyclopenta-2,4-dien-1-yl(diethyl)phosphane;cyclopentane?
The canonical SMILES for cobalt;cyclopenta-2,4-dien-1-yl(diethyl)phosphane;cyclopentane is CCP(CC)[c-]1cccc1.[Co].[cH-]1[cH-][cH-][cH-][cH-]1.
What is the InChIKey of cobalt;cyclopenta-2,4-dien-1-yl(diethyl)phosphane;cyclopentane?
The InChIKey is HQWIXFFGEYLUEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14P.C5H5.Co/c1-3-10(4-2)9-7-5-6-8-9;1-2-4-5-3-1;/h5-8H,3-4H2,1-2H3;1-5H;/q-1;-5;.
What are the key properties of cobalt;cyclopenta-2,4-dien-1-yl(diethyl)phosphane;cyclopentane?
cobalt;cyclopenta-2,4-dien-1-yl(diethyl)phosphane;cyclopentane has a molecular weight of 277.21 g/mol, XLogP of 3.96, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt;cyclopenta-2,4-dien-1-yl(diethyl)phosphane;cyclopentane is sourced from PubChem (CID 174798718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).