(3-bromo-5-chloro-2-fluorophenyl)-trimethylsilane

C9H11BrClFSi — CID 171366750

IUPAC(3-bromo-5-chloro-2-fluorophenyl)-trimethylsilane
SMILESC[Si](C)(C)c1cc(Cl)cc(Br)c1F
InChIInChI=1S/C9H11BrClFSi/c1-13(2,3)8-5-6(11)4-7(10)9(8)12/h4-5H,1-3H3
InChIKeyWUQXOKMZLMGBPF-UHFFFAOYSA-N
MW281.63 g/mol
LogP3.79
Rot. Bonds1

About (3-bromo-5-chloro-2-fluorophenyl)-trimethylsilane

(3-bromo-5-chloro-2-fluorophenyl)-trimethylsilane (PubChem CID 171366750) has the molecular formula C9H11BrClFSi and a molecular weight of 281.63 g/mol. Its IUPAC name is (3-bromo-5-chloro-2-fluorophenyl)-trimethylsilane.

Molecular Properties

Compound Name(3-bromo-5-chloro-2-fluorophenyl)-trimethylsilane
PubChem CID171366750
Molecular FormulaC9H11BrClFSi
Molecular Weight281.63 g/mol
Exact Mass279.95
IUPAC Name(3-bromo-5-chloro-2-fluorophenyl)-trimethylsilane
SMILESC[Si](C)(C)c1cc(Cl)cc(Br)c1F
InChIInChI=1S/C9H11BrClFSi/c1-13(2,3)8-5-6(11)4-7(10)9(8)12/h4-5H,1-3H3
InChIKeyWUQXOKMZLMGBPF-UHFFFAOYSA-N
XLogP3.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.63
LogP ≤ 53.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

(5-chloro-2-fluoro-3-trimethylsilylphenyl)boronic acid
CID 171367936
(5-chloro-2-fluoro-3-pyridinyl)-trimethylsilane
CID 164890893
(2-bromo-4-chloro-6-fluorophenoxy)-trimethylsilane
CID 167737943
(6-bromo-4-chloro-2,3-difluorophenyl)-trimethylsilane
CID 164894251
1-bromo-5-chloro-3-fluoro-2-methoxybenzene
CID 3863039
1-bromo-3,5-dichloro-2-methylbenzene
CID 10263661
1-bromo-2,5-dichloro-3-methylbenzene
CID 44891130
1-bromo-3-chloro-2,4,5-trifluorobenzene
CID 14978107
2,6-dibromo-4-chlorophenol
CID 21394
2-bromo-5-chloro-1,3-difluorobenzene
CID 2761407
1-bromo-5-chloro-2-(chloromethyl)-3-fluorobenzene
CID 131587303
(5-chloro-2-fluoro-4-methylphenyl)-trimethylsilane
CID 131066790

Frequently Asked Questions

What is the IUPAC name of (3-bromo-5-chloro-2-fluorophenyl)-trimethylsilane?
The IUPAC name of (3-bromo-5-chloro-2-fluorophenyl)-trimethylsilane (CID 171366750) is (3-bromo-5-chloro-2-fluorophenyl)-trimethylsilane.
What is the SMILES notation for (3-bromo-5-chloro-2-fluorophenyl)-trimethylsilane?
The canonical SMILES for (3-bromo-5-chloro-2-fluorophenyl)-trimethylsilane is C[Si](C)(C)c1cc(Cl)cc(Br)c1F.
What is the InChIKey of (3-bromo-5-chloro-2-fluorophenyl)-trimethylsilane?
The InChIKey is WUQXOKMZLMGBPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11BrClFSi/c1-13(2,3)8-5-6(11)4-7(10)9(8)12/h4-5H,1-3H3.
What are the key properties of (3-bromo-5-chloro-2-fluorophenyl)-trimethylsilane?
(3-bromo-5-chloro-2-fluorophenyl)-trimethylsilane has a molecular weight of 281.63 g/mol, XLogP of 3.79, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromo-5-chloro-2-fluorophenyl)-trimethylsilane is sourced from PubChem (CID 171366750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).