cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide

C10H15P-2 — CID 139170668

IUPACcyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide
SMILESCC(C)(C)C[P-]c1ccc[cH-]1
InChIInChI=1S/C10H15P/c1-10(2,3)8-11-9-6-4-5-7-9/h4-7H,8H2,1-3H3/q-2
InChIKeyLTYKQPUWPKYGPD-UHFFFAOYSA-N
MW166.20 g/mol
LogP3.02
Rot. Bonds2

About cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide

cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide (PubChem CID 139170668) has the molecular formula C10H15P-2 and a molecular weight of 166.20 g/mol. Its IUPAC name is cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide.

Molecular Properties

Compound Namecyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide
PubChem CID139170668
Molecular FormulaC10H15P-2
Molecular Weight166.20 g/mol
Exact Mass166.09
IUPAC Namecyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide
SMILESCC(C)(C)C[P-]c1ccc[cH-]1
InChIInChI=1S/C10H15P/c1-10(2,3)8-11-9-6-4-5-7-9/h4-7H,8H2,1-3H3/q-2
InChIKeyLTYKQPUWPKYGPD-UHFFFAOYSA-N
XLogP3.02
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.20
LogP ≤ 53.02
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 cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide?
The IUPAC name of cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide (CID 139170668) is cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide.
What is the SMILES notation for cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide?
The canonical SMILES for cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide is CC(C)(C)C[P-]c1ccc[cH-]1.
What is the InChIKey of cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide?
The InChIKey is LTYKQPUWPKYGPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15P/c1-10(2,3)8-11-9-6-4-5-7-9/h4-7H,8H2,1-3H3/q-2.
What are the key properties of cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide?
cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide has a molecular weight of 166.20 g/mol, XLogP of 3.02, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta-1,3-dien-1-yl(2,2-dimethylpropyl)phosphanide is sourced from PubChem (CID 139170668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).