[2-(2,3-difluorophenyl)phenyl]methoxy-tri(propan-2-yl)silane

C22H30F2OSi — CID 102075218

IUPAC[2-(2,3-difluorophenyl)phenyl]methoxy-tri(propan-2-yl)silane
SMILESCC(C)[Si](OCc1ccccc1-c1cccc(F)c1F)(C(C)C)C(C)C
InChIInChI=1S/C22H30F2OSi/c1-15(2)26(16(3)4,17(5)6)25-14-18-10-7-8-11-19(18)20-12-9-13-21(23)22(20)24/h7-13,15-17H,14H2,1-6H3
InChIKeyJEYJKXLEUYQTNF-UHFFFAOYSA-N
MW376.56 g/mol
LogP7.32
Rot. Bonds7

About [2-(2,3-difluorophenyl)phenyl]methoxy-tri(propan-2-yl)silane

[2-(2,3-difluorophenyl)phenyl]methoxy-tri(propan-2-yl)silane (PubChem CID 102075218) has the molecular formula C22H30F2OSi and a molecular weight of 376.56 g/mol. Its IUPAC name is [2-(2,3-difluorophenyl)phenyl]methoxy-tri(propan-2-yl)silane.

Molecular Properties

Compound Name[2-(2,3-difluorophenyl)phenyl]methoxy-tri(propan-2-yl)silane
PubChem CID102075218
Molecular FormulaC22H30F2OSi
Molecular Weight376.56 g/mol
Exact Mass376.20
IUPAC Name[2-(2,3-difluorophenyl)phenyl]methoxy-tri(propan-2-yl)silane
SMILESCC(C)[Si](OCc1ccccc1-c1cccc(F)c1F)(C(C)C)C(C)C
InChIInChI=1S/C22H30F2OSi/c1-15(2)26(16(3)4,17(5)6)25-14-18-10-7-8-11-19(18)20-12-9-13-21(23)22(20)24/h7-13,15-17H,14H2,1-6H3
InChIKeyJEYJKXLEUYQTNF-UHFFFAOYSA-N
XLogP7.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.56
LogP ≤ 57.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze [2-(2,3-difluorophenyl)phenyl]methoxy-tri(propan-2-yl)silane 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

2-[4-[Benzyl(dimethyl)silyl]phenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 168281096
2-[4-[Dimethyl(phenyl)silyl]phenyl]-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 168285849
(2-((4-Fluorophenyl)dimethylsilyl)phenyl)methanol
CID 11989534
Silane, trimethyl(2,2,2-trifluoro-1,1-diphenylethoxy)-
CID 11255795
Silane, triethyl(phenylmethoxy)-
CID 563229
Triethylsilyloxymethyl-4-fluorobenzene
CID 11107483
tert-Butyl(4-fluorobenzyloxy)dimethylsilane
CID 13861700
Silane, (1,1-dimethylethyl)dimethyl(phenylmethoxy)-
CID 596642
Dimethyl(diphenylmethoxy)(pentafluorophenyl)silane
CID 4581060
2-Fluorobenzyl alcohol, tert-butyldimethylsilyl ether
CID 91728155
2,3-Diphenyl-2,3-bis(triethylsiloxy)hexafluorobutane
CID 12534368
Trimethyl-(2,2,2-trifluoro-1-naphthalen-2-ylethoxy)silane
CID 15488123

Frequently Asked Questions

What is the IUPAC name of [2-(2,3-difluorophenyl)phenyl]methoxy-tri(propan-2-yl)silane?
The IUPAC name of [2-(2,3-difluorophenyl)phenyl]methoxy-tri(propan-2-yl)silane (CID 102075218) is [2-(2,3-difluorophenyl)phenyl]methoxy-tri(propan-2-yl)silane.
What is the SMILES notation for [2-(2,3-difluorophenyl)phenyl]methoxy-tri(propan-2-yl)silane?
The canonical SMILES for [2-(2,3-difluorophenyl)phenyl]methoxy-tri(propan-2-yl)silane is CC(C)[Si](OCc1ccccc1-c1cccc(F)c1F)(C(C)C)C(C)C.
What is the InChIKey of [2-(2,3-difluorophenyl)phenyl]methoxy-tri(propan-2-yl)silane?
The InChIKey is JEYJKXLEUYQTNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30F2OSi/c1-15(2)26(16(3)4,17(5)6)25-14-18-10-7-8-11-19(18)20-12-9-13-21(23)22(20)24/h7-13,15-17H,14H2,1-6H3.
What are the key properties of [2-(2,3-difluorophenyl)phenyl]methoxy-tri(propan-2-yl)silane?
[2-(2,3-difluorophenyl)phenyl]methoxy-tri(propan-2-yl)silane has a molecular weight of 376.56 g/mol, XLogP of 7.32, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,3-difluorophenyl)phenyl]methoxy-tri(propan-2-yl)silane is sourced from PubChem (CID 102075218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).