[2,6-difluoro-4-(2-trimethylsilylethynyl)phenyl]methanol

C12H14F2OSi — CID 151363788

IUPAC[2,6-difluoro-4-(2-trimethylsilylethynyl)phenyl]methanol
SMILESC[Si](C)(C)C#Cc1cc(F)c(CO)c(F)c1
InChIInChI=1S/C12H14F2OSi/c1-16(2,3)5-4-9-6-11(13)10(8-15)12(14)7-9/h6-7,15H,8H2,1-3H3
InChIKeyOOZYFBOCRRAKHP-UHFFFAOYSA-N
MW240.32 g/mol
LogP2.69
Rot. Bonds1

About [2,6-difluoro-4-(2-trimethylsilylethynyl)phenyl]methanol

[2,6-difluoro-4-(2-trimethylsilylethynyl)phenyl]methanol (PubChem CID 151363788) has the molecular formula C12H14F2OSi and a molecular weight of 240.32 g/mol. Its IUPAC name is [2,6-difluoro-4-(2-trimethylsilylethynyl)phenyl]methanol.

Molecular Properties

Compound Name[2,6-difluoro-4-(2-trimethylsilylethynyl)phenyl]methanol
PubChem CID151363788
Molecular FormulaC12H14F2OSi
Molecular Weight240.32 g/mol
Exact Mass240.08
IUPAC Name[2,6-difluoro-4-(2-trimethylsilylethynyl)phenyl]methanol
SMILESC[Si](C)(C)C#Cc1cc(F)c(CO)c(F)c1
InChIInChI=1S/C12H14F2OSi/c1-16(2,3)5-4-9-6-11(13)10(8-15)12(14)7-9/h6-7,15H,8H2,1-3H3
InChIKeyOOZYFBOCRRAKHP-UHFFFAOYSA-N
XLogP2.69
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.32
LogP ≤ 52.69
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'}

Analyze [2,6-difluoro-4-(2-trimethylsilylethynyl)phenyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 2,6-difluoro-4-(2-trimethylsilylethynyl)benzoate
CID 140966195
[4-(2-trimethylsilylethynyl)thiophen-2-yl]methanol
CID 177059961
4-(2-trimethylsilylethynyl)phenol
CID 10750210
2-[2,4-difluoro-5-(2-trimethylsilylethynyl)phenyl]ethynyl-trimethylsilane
CID 102134851
3-methyl-5-(2-trimethylsilylethynyl)phenol
CID 132839021
(2,6-difluoro-4-methoxyphenyl)methanol
CID 3736239
4-[2-[4-[2-[4-(2-trimethylsilylethynyl)phenyl]ethynyl]phenyl]ethynyl]phenol
CID 11843653
[3,6-bis(2-trimethylsilylethynyl)-9H-fluoren-1-yl]methanol
CID 174060733
3,5-bis(2-trimethylsilylethynyl)benzaldehyde
CID 10469998
[2,6-difluoro-4-(methoxymethyl)phenyl]methanol
CID 130130923
[4-(difluoromethyl)-2,6-difluorophenyl]methanol
CID 131189605
(2-bromo-7-fluoro-4,6-dimethylquinolin-3-yl)methanol
CID 178041010

Frequently Asked Questions

What is the IUPAC name of [2,6-difluoro-4-(2-trimethylsilylethynyl)phenyl]methanol?
The IUPAC name of [2,6-difluoro-4-(2-trimethylsilylethynyl)phenyl]methanol (CID 151363788) is [2,6-difluoro-4-(2-trimethylsilylethynyl)phenyl]methanol.
What is the SMILES notation for [2,6-difluoro-4-(2-trimethylsilylethynyl)phenyl]methanol?
The canonical SMILES for [2,6-difluoro-4-(2-trimethylsilylethynyl)phenyl]methanol is C[Si](C)(C)C#Cc1cc(F)c(CO)c(F)c1.
What is the InChIKey of [2,6-difluoro-4-(2-trimethylsilylethynyl)phenyl]methanol?
The InChIKey is OOZYFBOCRRAKHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14F2OSi/c1-16(2,3)5-4-9-6-11(13)10(8-15)12(14)7-9/h6-7,15H,8H2,1-3H3.
What are the key properties of [2,6-difluoro-4-(2-trimethylsilylethynyl)phenyl]methanol?
[2,6-difluoro-4-(2-trimethylsilylethynyl)phenyl]methanol has a molecular weight of 240.32 g/mol, XLogP of 2.69, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2,6-difluoro-4-(2-trimethylsilylethynyl)phenyl]methanol is sourced from PubChem (CID 151363788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).