(3,5-difluorophenyl)methyl-ethoxy-dimethylsilane

C11H16F2OSi — CID 90171411

IUPAC(3,5-difluorophenyl)methyl-ethoxy-dimethylsilane
SMILESCCO[Si](C)(C)Cc1cc(F)cc(F)c1
InChIInChI=1S/C11H16F2OSi/c1-4-14-15(2,3)8-9-5-10(12)7-11(13)6-9/h5-7H,4,8H2,1-3H3
InChIKeyKBSHQEHBLGWKPY-UHFFFAOYSA-N
MW230.33 g/mol
LogP3.29
Rot. Bonds4

About (3,5-difluorophenyl)methyl-ethoxy-dimethylsilane

(3,5-difluorophenyl)methyl-ethoxy-dimethylsilane (PubChem CID 90171411) has the molecular formula C11H16F2OSi and a molecular weight of 230.33 g/mol. Its IUPAC name is (3,5-difluorophenyl)methyl-ethoxy-dimethylsilane.

Molecular Properties

Compound Name(3,5-difluorophenyl)methyl-ethoxy-dimethylsilane
PubChem CID90171411
Molecular FormulaC11H16F2OSi
Molecular Weight230.33 g/mol
Exact Mass230.09
IUPAC Name(3,5-difluorophenyl)methyl-ethoxy-dimethylsilane
SMILESCCO[Si](C)(C)Cc1cc(F)cc(F)c1
InChIInChI=1S/C11H16F2OSi/c1-4-14-15(2,3)8-9-5-10(12)7-11(13)6-9/h5-7H,4,8H2,1-3H3
InChIKeyKBSHQEHBLGWKPY-UHFFFAOYSA-N
XLogP3.29
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.33
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (3,5-difluorophenyl)methyl-ethoxy-dimethylsilane?
The IUPAC name of (3,5-difluorophenyl)methyl-ethoxy-dimethylsilane (CID 90171411) is (3,5-difluorophenyl)methyl-ethoxy-dimethylsilane.
What is the SMILES notation for (3,5-difluorophenyl)methyl-ethoxy-dimethylsilane?
The canonical SMILES for (3,5-difluorophenyl)methyl-ethoxy-dimethylsilane is CCO[Si](C)(C)Cc1cc(F)cc(F)c1.
What is the InChIKey of (3,5-difluorophenyl)methyl-ethoxy-dimethylsilane?
The InChIKey is KBSHQEHBLGWKPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16F2OSi/c1-4-14-15(2,3)8-9-5-10(12)7-11(13)6-9/h5-7H,4,8H2,1-3H3.
What are the key properties of (3,5-difluorophenyl)methyl-ethoxy-dimethylsilane?
(3,5-difluorophenyl)methyl-ethoxy-dimethylsilane has a molecular weight of 230.33 g/mol, XLogP of 3.29, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-difluorophenyl)methyl-ethoxy-dimethylsilane is sourced from PubChem (CID 90171411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).