(6-bromo-4-chloro-2,3-difluorophenyl)-trimethylsilane

C9H10BrClF2Si — CID 164894251

IUPAC(6-bromo-4-chloro-2,3-difluorophenyl)-trimethylsilane
SMILESC[Si](C)(C)c1c(Br)cc(Cl)c(F)c1F
InChIInChI=1S/C9H10BrClF2Si/c1-14(2,3)9-5(10)4-6(11)7(12)8(9)13/h4H,1-3H3
InChIKeyJTMFEWKSQHBYOT-UHFFFAOYSA-N
MW299.62 g/mol
LogP3.93
Rot. Bonds1

About (6-bromo-4-chloro-2,3-difluorophenyl)-trimethylsilane

(6-bromo-4-chloro-2,3-difluorophenyl)-trimethylsilane (PubChem CID 164894251) has the molecular formula C9H10BrClF2Si and a molecular weight of 299.62 g/mol. Its IUPAC name is (6-bromo-4-chloro-2,3-difluorophenyl)-trimethylsilane.

Molecular Properties

Compound Name(6-bromo-4-chloro-2,3-difluorophenyl)-trimethylsilane
PubChem CID164894251
Molecular FormulaC9H10BrClF2Si
Molecular Weight299.62 g/mol
Exact Mass297.94
IUPAC Name(6-bromo-4-chloro-2,3-difluorophenyl)-trimethylsilane
SMILESC[Si](C)(C)c1c(Br)cc(Cl)c(F)c1F
InChIInChI=1S/C9H10BrClF2Si/c1-14(2,3)9-5(10)4-6(11)7(12)8(9)13/h4H,1-3H3
InChIKeyJTMFEWKSQHBYOT-UHFFFAOYSA-N
XLogP3.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.62
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 (6-bromo-4-chloro-2,3-difluorophenyl)-trimethylsilane?
The IUPAC name of (6-bromo-4-chloro-2,3-difluorophenyl)-trimethylsilane (CID 164894251) is (6-bromo-4-chloro-2,3-difluorophenyl)-trimethylsilane.
What is the SMILES notation for (6-bromo-4-chloro-2,3-difluorophenyl)-trimethylsilane?
The canonical SMILES for (6-bromo-4-chloro-2,3-difluorophenyl)-trimethylsilane is C[Si](C)(C)c1c(Br)cc(Cl)c(F)c1F.
What is the InChIKey of (6-bromo-4-chloro-2,3-difluorophenyl)-trimethylsilane?
The InChIKey is JTMFEWKSQHBYOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrClF2Si/c1-14(2,3)9-5(10)4-6(11)7(12)8(9)13/h4H,1-3H3.
What are the key properties of (6-bromo-4-chloro-2,3-difluorophenyl)-trimethylsilane?
(6-bromo-4-chloro-2,3-difluorophenyl)-trimethylsilane has a molecular weight of 299.62 g/mol, XLogP of 3.93, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (6-bromo-4-chloro-2,3-difluorophenyl)-trimethylsilane is sourced from PubChem (CID 164894251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).