diiodocobalt;1,2,3,4,5-pentamethylcyclopenta-1,3-diene;triethylphosphanium

C16H31CoI2P — CID 11987151

IUPACdiiodocobalt;1,2,3,4,5-pentamethylcyclopenta-1,3-diene;triethylphosphanium
SMILESCC[PH+](CC)CC.Cc1c(C)c(C)[c-](C)c1C.I[Co]I
InChIInChI=1S/C10H15.C6H15P.Co.2HI/c1-6-7(2)9(4)10(5)8(6)3;1-4-7(5-2)6-3;;;/h1-5H3;4-6H2,1-3H3;;2*1H/q-1;;+2;;/p-1
InChIKeyUSLXJDSFZDFHJK-UHFFFAOYSA-M
MW567.14 g/mol
LogP6.98
Rot. Bonds3

About diiodocobalt;1,2,3,4,5-pentamethylcyclopenta-1,3-diene;triethylphosphanium

diiodocobalt;1,2,3,4,5-pentamethylcyclopenta-1,3-diene;triethylphosphanium (PubChem CID 11987151) has the molecular formula C16H31CoI2P and a molecular weight of 567.14 g/mol. Its IUPAC name is diiodocobalt;1,2,3,4,5-pentamethylcyclopenta-1,3-diene;triethylphosphanium.

Molecular Properties

Compound Namediiodocobalt;1,2,3,4,5-pentamethylcyclopenta-1,3-diene;triethylphosphanium
PubChem CID11987151
Molecular FormulaC16H31CoI2P
Molecular Weight567.14 g/mol
Exact Mass566.96
IUPAC Namediiodocobalt;1,2,3,4,5-pentamethylcyclopenta-1,3-diene;triethylphosphanium
SMILESCC[PH+](CC)CC.Cc1c(C)c(C)[c-](C)c1C.I[Co]I
InChIInChI=1S/C10H15.C6H15P.Co.2HI/c1-6-7(2)9(4)10(5)8(6)3;1-4-7(5-2)6-3;;;/h1-5H3;4-6H2,1-3H3;;2*1H/q-1;;+2;;/p-1
InChIKeyUSLXJDSFZDFHJK-UHFFFAOYSA-M
XLogP6.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500567.14
LogP ≤ 56.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of diiodocobalt;1,2,3,4,5-pentamethylcyclopenta-1,3-diene;triethylphosphanium?
The IUPAC name of diiodocobalt;1,2,3,4,5-pentamethylcyclopenta-1,3-diene;triethylphosphanium (CID 11987151) is diiodocobalt;1,2,3,4,5-pentamethylcyclopenta-1,3-diene;triethylphosphanium.
What is the SMILES notation for diiodocobalt;1,2,3,4,5-pentamethylcyclopenta-1,3-diene;triethylphosphanium?
The canonical SMILES for diiodocobalt;1,2,3,4,5-pentamethylcyclopenta-1,3-diene;triethylphosphanium is CC[PH+](CC)CC.Cc1c(C)c(C)[c-](C)c1C.I[Co]I.
What is the InChIKey of diiodocobalt;1,2,3,4,5-pentamethylcyclopenta-1,3-diene;triethylphosphanium?
The InChIKey is USLXJDSFZDFHJK-UHFFFAOYSA-M. The full InChI is InChI=1S/C10H15.C6H15P.Co.2HI/c1-6-7(2)9(4)10(5)8(6)3;1-4-7(5-2)6-3;;;/h1-5H3;4-6H2,1-3H3;;2*1H/q-1;;+2;;/p-1.
What are the key properties of diiodocobalt;1,2,3,4,5-pentamethylcyclopenta-1,3-diene;triethylphosphanium?
diiodocobalt;1,2,3,4,5-pentamethylcyclopenta-1,3-diene;triethylphosphanium has a molecular weight of 567.14 g/mol, XLogP of 6.98, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for diiodocobalt;1,2,3,4,5-pentamethylcyclopenta-1,3-diene;triethylphosphanium is sourced from PubChem (CID 11987151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).