(2-bromocyclohept-2-en-1-yl)-trimethylsilane

C10H19BrSi — CID 15647184

IUPAC(2-bromocyclohept-2-en-1-yl)-trimethylsilane
SMILESC[Si](C)(C)C1CCCCC=C1Br
InChIInChI=1S/C10H19BrSi/c1-12(2,3)10-8-6-4-5-7-9(10)11/h7,10H,4-6,8H2,1-3H3
InChIKeyXOVLUWJSOFXQTG-UHFFFAOYSA-N
MW247.25 g/mol
LogP4.55
Rot. Bonds1

About (2-bromocyclohept-2-en-1-yl)-trimethylsilane

(2-bromocyclohept-2-en-1-yl)-trimethylsilane (PubChem CID 15647184) has the molecular formula C10H19BrSi and a molecular weight of 247.25 g/mol. Its IUPAC name is (2-bromocyclohept-2-en-1-yl)-trimethylsilane.

Molecular Properties

Compound Name(2-bromocyclohept-2-en-1-yl)-trimethylsilane
PubChem CID15647184
Molecular FormulaC10H19BrSi
Molecular Weight247.25 g/mol
Exact Mass246.04
IUPAC Name(2-bromocyclohept-2-en-1-yl)-trimethylsilane
SMILESC[Si](C)(C)C1CCCCC=C1Br
InChIInChI=1S/C10H19BrSi/c1-12(2,3)10-8-6-4-5-7-9(10)11/h7,10H,4-6,8H2,1-3H3
InChIKeyXOVLUWJSOFXQTG-UHFFFAOYSA-N
XLogP4.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.25
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 (2-bromocyclohept-2-en-1-yl)-trimethylsilane?
The IUPAC name of (2-bromocyclohept-2-en-1-yl)-trimethylsilane (CID 15647184) is (2-bromocyclohept-2-en-1-yl)-trimethylsilane.
What is the SMILES notation for (2-bromocyclohept-2-en-1-yl)-trimethylsilane?
The canonical SMILES for (2-bromocyclohept-2-en-1-yl)-trimethylsilane is C[Si](C)(C)C1CCCCC=C1Br.
What is the InChIKey of (2-bromocyclohept-2-en-1-yl)-trimethylsilane?
The InChIKey is XOVLUWJSOFXQTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19BrSi/c1-12(2,3)10-8-6-4-5-7-9(10)11/h7,10H,4-6,8H2,1-3H3.
What are the key properties of (2-bromocyclohept-2-en-1-yl)-trimethylsilane?
(2-bromocyclohept-2-en-1-yl)-trimethylsilane has a molecular weight of 247.25 g/mol, XLogP of 4.55, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2-bromocyclohept-2-en-1-yl)-trimethylsilane is sourced from PubChem (CID 15647184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).