3-[dimethyl(phenyl)silyl]prop-2-ynyl-diphenylphosphane

C23H23PSi — CID 132942765

IUPAC3-[dimethyl(phenyl)silyl]prop-2-ynyl-diphenylphosphane
SMILESC[Si](C)(C#CCP(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C23H23PSi/c1-25(2,23-17-10-5-11-18-23)20-12-19-24(21-13-6-3-7-14-21)22-15-8-4-9-16-22/h3-11,13-18H,19H2,1-2H3
InChIKeyDNUFLVZQIDDVQY-UHFFFAOYSA-N
MW358.50 g/mol
LogP4.28
Rot. Bonds4

About 3-[dimethyl(phenyl)silyl]prop-2-ynyl-diphenylphosphane

3-[dimethyl(phenyl)silyl]prop-2-ynyl-diphenylphosphane (PubChem CID 132942765) has the molecular formula C23H23PSi and a molecular weight of 358.50 g/mol. Its IUPAC name is 3-[dimethyl(phenyl)silyl]prop-2-ynyl-diphenylphosphane.

Molecular Properties

Compound Name3-[dimethyl(phenyl)silyl]prop-2-ynyl-diphenylphosphane
PubChem CID132942765
Molecular FormulaC23H23PSi
Molecular Weight358.50 g/mol
Exact Mass358.13
IUPAC Name3-[dimethyl(phenyl)silyl]prop-2-ynyl-diphenylphosphane
SMILESC[Si](C)(C#CCP(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C23H23PSi/c1-25(2,23-17-10-5-11-18-23)20-12-19-24(21-13-6-3-7-14-21)22-15-8-4-9-16-22/h3-11,13-18H,19H2,1-2H3
InChIKeyDNUFLVZQIDDVQY-UHFFFAOYSA-N
XLogP4.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.50
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

3-iodoprop-1-ynyl-dimethyl-phenylsilane
CID 164685330
3-methoxyprop-1-ynyl-dimethyl-phenylsilane
CID 140704450
dimethyl-oct-1-ynyl-phenylsilane
CID 13357120
CID 177490000
CID 177490000
bis(diphenylphosphanylmethyl)-trimethylsilylphosphane
CID 578775
diphenyl(triphenylsilylmethyl)phosphane
CID 13086802
dimethyl-(2-naphthalen-1-ylethynyl)-phenylsilane
CID 102396235
2-[2-[dimethyl(phenyl)silyl]ethynyl]phenol
CID 132557656
ethyl(diphenyl)phosphane;methyl(diphenyl)phosphane
CID 158097838
ethyl(diphenyl)phosphane;trichlororuthenium
CID 159343437
diphenyl(2-triphenylsilylethyl)phosphane
CID 14007797
2-[dichloro(phenyl)silyl]ethyl-diphenylphosphane
CID 13086808

Frequently Asked Questions

What is the IUPAC name of 3-[dimethyl(phenyl)silyl]prop-2-ynyl-diphenylphosphane?
The IUPAC name of 3-[dimethyl(phenyl)silyl]prop-2-ynyl-diphenylphosphane (CID 132942765) is 3-[dimethyl(phenyl)silyl]prop-2-ynyl-diphenylphosphane.
What is the SMILES notation for 3-[dimethyl(phenyl)silyl]prop-2-ynyl-diphenylphosphane?
The canonical SMILES for 3-[dimethyl(phenyl)silyl]prop-2-ynyl-diphenylphosphane is C[Si](C)(C#CCP(c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of 3-[dimethyl(phenyl)silyl]prop-2-ynyl-diphenylphosphane?
The InChIKey is DNUFLVZQIDDVQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23PSi/c1-25(2,23-17-10-5-11-18-23)20-12-19-24(21-13-6-3-7-14-21)22-15-8-4-9-16-22/h3-11,13-18H,19H2,1-2H3.
What are the key properties of 3-[dimethyl(phenyl)silyl]prop-2-ynyl-diphenylphosphane?
3-[dimethyl(phenyl)silyl]prop-2-ynyl-diphenylphosphane has a molecular weight of 358.50 g/mol, XLogP of 4.28, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[dimethyl(phenyl)silyl]prop-2-ynyl-diphenylphosphane is sourced from PubChem (CID 132942765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).