2-cyclopenta-2,4-dien-1-ylpropyl-bis(trimethylsilyloxy)phosphane

C14H29O2PSi2 — CID 12034304

IUPAC2-cyclopenta-2,4-dien-1-ylpropyl-bis(trimethylsilyloxy)phosphane
SMILESCC(CP(O[Si](C)(C)C)O[Si](C)(C)C)C1C=CC=C1
InChIInChI=1S/C14H29O2PSi2/c1-13(14-10-8-9-11-14)12-17(15-18(2,3)4)16-19(5,6)7/h8-11,13-14H,12H2,1-7H3
InChIKeyUPZGCMPASDXWDZ-UHFFFAOYSA-N
MW316.53 g/mol
LogP5.38
Rot. Bonds7

About 2-cyclopenta-2,4-dien-1-ylpropyl-bis(trimethylsilyloxy)phosphane

2-cyclopenta-2,4-dien-1-ylpropyl-bis(trimethylsilyloxy)phosphane (PubChem CID 12034304) has the molecular formula C14H29O2PSi2 and a molecular weight of 316.53 g/mol. Its IUPAC name is 2-cyclopenta-2,4-dien-1-ylpropyl-bis(trimethylsilyloxy)phosphane.

Molecular Properties

Compound Name2-cyclopenta-2,4-dien-1-ylpropyl-bis(trimethylsilyloxy)phosphane
PubChem CID12034304
Molecular FormulaC14H29O2PSi2
Molecular Weight316.53 g/mol
Exact Mass316.14
IUPAC Name2-cyclopenta-2,4-dien-1-ylpropyl-bis(trimethylsilyloxy)phosphane
SMILESCC(CP(O[Si](C)(C)C)O[Si](C)(C)C)C1C=CC=C1
InChIInChI=1S/C14H29O2PSi2/c1-13(14-10-8-9-11-14)12-17(15-18(2,3)4)16-19(5,6)7/h8-11,13-14H,12H2,1-7H3
InChIKeyUPZGCMPASDXWDZ-UHFFFAOYSA-N
XLogP5.38
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.53
LogP ≤ 55.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopenta-2,4-dien-1-ylpropyl-bis(trimethylsilyloxy)phosphane?
The IUPAC name of 2-cyclopenta-2,4-dien-1-ylpropyl-bis(trimethylsilyloxy)phosphane (CID 12034304) is 2-cyclopenta-2,4-dien-1-ylpropyl-bis(trimethylsilyloxy)phosphane.
What is the SMILES notation for 2-cyclopenta-2,4-dien-1-ylpropyl-bis(trimethylsilyloxy)phosphane?
The canonical SMILES for 2-cyclopenta-2,4-dien-1-ylpropyl-bis(trimethylsilyloxy)phosphane is CC(CP(O[Si](C)(C)C)O[Si](C)(C)C)C1C=CC=C1.
What is the InChIKey of 2-cyclopenta-2,4-dien-1-ylpropyl-bis(trimethylsilyloxy)phosphane?
The InChIKey is UPZGCMPASDXWDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29O2PSi2/c1-13(14-10-8-9-11-14)12-17(15-18(2,3)4)16-19(5,6)7/h8-11,13-14H,12H2,1-7H3.
What are the key properties of 2-cyclopenta-2,4-dien-1-ylpropyl-bis(trimethylsilyloxy)phosphane?
2-cyclopenta-2,4-dien-1-ylpropyl-bis(trimethylsilyloxy)phosphane has a molecular weight of 316.53 g/mol, XLogP of 5.38, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopenta-2,4-dien-1-ylpropyl-bis(trimethylsilyloxy)phosphane is sourced from PubChem (CID 12034304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).