(2,2-difluoro-1-naphthalen-2-ylethenoxy)-trimethylsilane

C15H16F2OSi — CID 175380939

IUPAC(2,2-difluoro-1-naphthalen-2-ylethenoxy)-trimethylsilane
SMILESC[Si](C)(C)OC(=C(F)F)c1ccc2ccccc2c1
InChIInChI=1S/C15H16F2OSi/c1-19(2,3)18-14(15(16)17)13-9-8-11-6-4-5-7-12(11)10-13/h4-10H,1-3H3
InChIKeyAUPWRPGRNHLRTQ-UHFFFAOYSA-N
MW278.37 g/mol
LogP5.26
Rot. Bonds3

About (2,2-difluoro-1-naphthalen-2-ylethenoxy)-trimethylsilane

(2,2-difluoro-1-naphthalen-2-ylethenoxy)-trimethylsilane (PubChem CID 175380939) has the molecular formula C15H16F2OSi and a molecular weight of 278.37 g/mol. Its IUPAC name is (2,2-difluoro-1-naphthalen-2-ylethenoxy)-trimethylsilane.

Molecular Properties

Compound Name(2,2-difluoro-1-naphthalen-2-ylethenoxy)-trimethylsilane
PubChem CID175380939
Molecular FormulaC15H16F2OSi
Molecular Weight278.37 g/mol
Exact Mass278.09
IUPAC Name(2,2-difluoro-1-naphthalen-2-ylethenoxy)-trimethylsilane
SMILESC[Si](C)(C)OC(=C(F)F)c1ccc2ccccc2c1
InChIInChI=1S/C15H16F2OSi/c1-19(2,3)18-14(15(16)17)13-9-8-11-6-4-5-7-12(11)10-13/h4-10H,1-3H3
InChIKeyAUPWRPGRNHLRTQ-UHFFFAOYSA-N
XLogP5.26
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500278.37
LogP ≤ 55.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2,2-difluoro-1-naphthalen-2-ylethenoxy)-trimethylsilane?
The IUPAC name of (2,2-difluoro-1-naphthalen-2-ylethenoxy)-trimethylsilane (CID 175380939) is (2,2-difluoro-1-naphthalen-2-ylethenoxy)-trimethylsilane.
What is the SMILES notation for (2,2-difluoro-1-naphthalen-2-ylethenoxy)-trimethylsilane?
The canonical SMILES for (2,2-difluoro-1-naphthalen-2-ylethenoxy)-trimethylsilane is C[Si](C)(C)OC(=C(F)F)c1ccc2ccccc2c1.
What is the InChIKey of (2,2-difluoro-1-naphthalen-2-ylethenoxy)-trimethylsilane?
The InChIKey is AUPWRPGRNHLRTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F2OSi/c1-19(2,3)18-14(15(16)17)13-9-8-11-6-4-5-7-12(11)10-13/h4-10H,1-3H3.
What are the key properties of (2,2-difluoro-1-naphthalen-2-ylethenoxy)-trimethylsilane?
(2,2-difluoro-1-naphthalen-2-ylethenoxy)-trimethylsilane has a molecular weight of 278.37 g/mol, XLogP of 5.26, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-difluoro-1-naphthalen-2-ylethenoxy)-trimethylsilane is sourced from PubChem (CID 175380939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).