dimethyl-[(4-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane

C16H15F5OSi — CID 91703917

IUPACdimethyl-[(4-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane
SMILESCc1ccc(CO[Si](C)(C)c2c(F)c(F)c(F)c(F)c2F)cc1
InChIInChI=1S/C16H15F5OSi/c1-9-4-6-10(7-5-9)8-22-23(2,3)16-14(20)12(18)11(17)13(19)15(16)21/h4-7H,8H2,1-3H3
InChIKeyWMVJFKNYKATDHL-UHFFFAOYSA-N
MW346.37 g/mol
LogP4.32
Rot. Bonds4

About dimethyl-[(4-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane

dimethyl-[(4-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane (PubChem CID 91703917) has the molecular formula C16H15F5OSi and a molecular weight of 346.37 g/mol. Its IUPAC name is dimethyl-[(4-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane.

Molecular Properties

Compound Namedimethyl-[(4-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane
PubChem CID91703917
Molecular FormulaC16H15F5OSi
Molecular Weight346.37 g/mol
Exact Mass346.08
IUPAC Namedimethyl-[(4-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane
SMILESCc1ccc(CO[Si](C)(C)c2c(F)c(F)c(F)c(F)c2F)cc1
InChIInChI=1S/C16H15F5OSi/c1-9-4-6-10(7-5-9)8-22-23(2,3)16-14(20)12(18)11(17)13(19)15(16)21/h4-7H,8H2,1-3H3
InChIKeyWMVJFKNYKATDHL-UHFFFAOYSA-N
XLogP4.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.37
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

(2-((4-Fluorophenyl)dimethylsilyl)phenyl)methanol
CID 11989534
Silane, triethyl(phenylmethoxy)-
CID 563229
((1-(2-Fluorophenyl)vinyl)oxy)trimethylsilane
CID 10954822
Triethylsilyloxymethyl-4-fluorobenzene
CID 11107483
tert-Butyl(4-fluorobenzyloxy)dimethylsilane
CID 13861700
Silane, (1,1-dimethylethyl)dimethyl(phenylmethoxy)-
CID 596642
Trimethyl[(4-methylphenyl)methoxy]silane
CID 13063937
4-Methylbenzyl alcohol, tert-butyldimethylsilyl ether
CID 21304531
Dimethyl(diphenylmethoxy)(pentafluorophenyl)silane
CID 4581060
2-Fluorobenzyl alcohol, tert-butyldimethylsilyl ether
CID 91728155
tert-Butyldimethyl((4-(trifluoromethyl)benzyl)oxy)silane
CID 11277728
Dimethyl-prop-2-enyl-[[4-(trifluoromethyl)phenyl]methoxy]silane
CID 11666259

Frequently Asked Questions

What is the IUPAC name of dimethyl-[(4-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane?
The IUPAC name of dimethyl-[(4-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane (CID 91703917) is dimethyl-[(4-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane.
What is the SMILES notation for dimethyl-[(4-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane?
The canonical SMILES for dimethyl-[(4-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane is Cc1ccc(CO[Si](C)(C)c2c(F)c(F)c(F)c(F)c2F)cc1.
What is the InChIKey of dimethyl-[(4-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane?
The InChIKey is WMVJFKNYKATDHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F5OSi/c1-9-4-6-10(7-5-9)8-22-23(2,3)16-14(20)12(18)11(17)13(19)15(16)21/h4-7H,8H2,1-3H3.
What are the key properties of dimethyl-[(4-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane?
dimethyl-[(4-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane has a molecular weight of 346.37 g/mol, XLogP of 4.32, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[(4-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane is sourced from PubChem (CID 91703917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).