(2-fluoro-6-isocyanophenyl)-trimethylsilane

C10H12FNSi — CID 22714980

IUPAC(2-fluoro-6-isocyanophenyl)-trimethylsilane
SMILES[C-]#[N+]c1cccc(F)c1[Si](C)(C)C
InChIInChI=1S/C10H12FNSi/c1-12-9-7-5-6-8(11)10(9)13(2,3)4/h5-7H,2-4H3
InChIKeyGWAKINQTPRXSAN-UHFFFAOYSA-N
MW193.30 g/mol
LogP2.92
Rot. Bonds1

About (2-fluoro-6-isocyanophenyl)-trimethylsilane

(2-fluoro-6-isocyanophenyl)-trimethylsilane (PubChem CID 22714980) has the molecular formula C10H12FNSi and a molecular weight of 193.30 g/mol. Its IUPAC name is (2-fluoro-6-isocyanophenyl)-trimethylsilane.

Molecular Properties

Compound Name(2-fluoro-6-isocyanophenyl)-trimethylsilane
PubChem CID22714980
Molecular FormulaC10H12FNSi
Molecular Weight193.30 g/mol
Exact Mass193.07
IUPAC Name(2-fluoro-6-isocyanophenyl)-trimethylsilane
SMILES[C-]#[N+]c1cccc(F)c1[Si](C)(C)C
InChIInChI=1S/C10H12FNSi/c1-12-9-7-5-6-8(11)10(9)13(2,3)4/h5-7H,2-4H3
InChIKeyGWAKINQTPRXSAN-UHFFFAOYSA-N
XLogP2.92
TPSA4.36 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.30
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2-fluoro-6-isocyanophenyl)-trimethylsilane?
The IUPAC name of (2-fluoro-6-isocyanophenyl)-trimethylsilane (CID 22714980) is (2-fluoro-6-isocyanophenyl)-trimethylsilane.
What is the SMILES notation for (2-fluoro-6-isocyanophenyl)-trimethylsilane?
The canonical SMILES for (2-fluoro-6-isocyanophenyl)-trimethylsilane is [C-]#[N+]c1cccc(F)c1[Si](C)(C)C.
What is the InChIKey of (2-fluoro-6-isocyanophenyl)-trimethylsilane?
The InChIKey is GWAKINQTPRXSAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNSi/c1-12-9-7-5-6-8(11)10(9)13(2,3)4/h5-7H,2-4H3.
What are the key properties of (2-fluoro-6-isocyanophenyl)-trimethylsilane?
(2-fluoro-6-isocyanophenyl)-trimethylsilane has a molecular weight of 193.30 g/mol, XLogP of 2.92, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-6-isocyanophenyl)-trimethylsilane is sourced from PubChem (CID 22714980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).