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

C16H15F5OSi — CID 91703256

IUPACdimethyl-[(2-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane
SMILESCc1ccccc1CO[Si](C)(C)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C16H15F5OSi/c1-9-6-4-5-7-10(9)8-22-23(2,3)16-14(20)12(18)11(17)13(19)15(16)21/h4-7H,8H2,1-3H3
InChIKeyRAQMHCJTYKXSNH-UHFFFAOYSA-N
MW346.37 g/mol
LogP4.32
Rot. Bonds4

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

dimethyl-[(2-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane (PubChem CID 91703256) has the molecular formula C16H15F5OSi and a molecular weight of 346.37 g/mol. Its IUPAC name is dimethyl-[(2-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane.

Molecular Properties

Compound Namedimethyl-[(2-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane
PubChem CID91703256
Molecular FormulaC16H15F5OSi
Molecular Weight346.37 g/mol
Exact Mass346.08
IUPAC Namedimethyl-[(2-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane
SMILESCc1ccccc1CO[Si](C)(C)c1c(F)c(F)c(F)c(F)c1F
InChIInChI=1S/C16H15F5OSi/c1-9-6-4-5-7-10(9)8-22-23(2,3)16-14(20)12(18)11(17)13(19)15(16)21/h4-7H,8H2,1-3H3
InChIKeyRAQMHCJTYKXSNH-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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Frequently Asked Questions

What is the IUPAC name of dimethyl-[(2-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane?
The IUPAC name of dimethyl-[(2-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane (CID 91703256) is dimethyl-[(2-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane.
What is the SMILES notation for dimethyl-[(2-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane?
The canonical SMILES for dimethyl-[(2-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane is Cc1ccccc1CO[Si](C)(C)c1c(F)c(F)c(F)c(F)c1F.
What is the InChIKey of dimethyl-[(2-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane?
The InChIKey is RAQMHCJTYKXSNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15F5OSi/c1-9-6-4-5-7-10(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-[(2-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane?
dimethyl-[(2-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-[(2-methylphenyl)methoxy]-(2,3,4,5,6-pentafluorophenyl)silane is sourced from PubChem (CID 91703256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).