2-[2-[dimethyl(phenyl)silyl]ethynyl]phenol

C16H16OSi — CID 132557656

IUPAC2-[2-[dimethyl(phenyl)silyl]ethynyl]phenol
SMILESC[Si](C)(C#Cc1ccccc1O)c1ccccc1
InChIInChI=1S/C16H16OSi/c1-18(2,15-9-4-3-5-10-15)13-12-14-8-6-7-11-16(14)17/h3-11,17H,1-2H3
InChIKeyJYDVLDGUDBPBHW-UHFFFAOYSA-N
MW252.39 g/mol
LogP2.90
Rot. Bonds1

About 2-[2-[dimethyl(phenyl)silyl]ethynyl]phenol

2-[2-[dimethyl(phenyl)silyl]ethynyl]phenol (PubChem CID 132557656) has the molecular formula C16H16OSi and a molecular weight of 252.39 g/mol. Its IUPAC name is 2-[2-[dimethyl(phenyl)silyl]ethynyl]phenol.

Molecular Properties

Compound Name2-[2-[dimethyl(phenyl)silyl]ethynyl]phenol
PubChem CID132557656
Molecular FormulaC16H16OSi
Molecular Weight252.39 g/mol
Exact Mass252.10
IUPAC Name2-[2-[dimethyl(phenyl)silyl]ethynyl]phenol
SMILESC[Si](C)(C#Cc1ccccc1O)c1ccccc1
InChIInChI=1S/C16H16OSi/c1-18(2,15-9-4-3-5-10-15)13-12-14-8-6-7-11-16(14)17/h3-11,17H,1-2H3
InChIKeyJYDVLDGUDBPBHW-UHFFFAOYSA-N
XLogP2.90
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.39
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[dimethyl(phenyl)silyl]ethynyl]phenol?
The IUPAC name of 2-[2-[dimethyl(phenyl)silyl]ethynyl]phenol (CID 132557656) is 2-[2-[dimethyl(phenyl)silyl]ethynyl]phenol.
What is the SMILES notation for 2-[2-[dimethyl(phenyl)silyl]ethynyl]phenol?
The canonical SMILES for 2-[2-[dimethyl(phenyl)silyl]ethynyl]phenol is C[Si](C)(C#Cc1ccccc1O)c1ccccc1.
What is the InChIKey of 2-[2-[dimethyl(phenyl)silyl]ethynyl]phenol?
The InChIKey is JYDVLDGUDBPBHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16OSi/c1-18(2,15-9-4-3-5-10-15)13-12-14-8-6-7-11-16(14)17/h3-11,17H,1-2H3.
What are the key properties of 2-[2-[dimethyl(phenyl)silyl]ethynyl]phenol?
2-[2-[dimethyl(phenyl)silyl]ethynyl]phenol has a molecular weight of 252.39 g/mol, XLogP of 2.90, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[dimethyl(phenyl)silyl]ethynyl]phenol is sourced from PubChem (CID 132557656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).