3-bromoprop-1-en-2-yloxy(trimethyl)silane

C6H13BrOSi — CID 12739597

IUPAC3-bromoprop-1-en-2-yloxy(trimethyl)silane
SMILESC=C(CBr)O[Si](C)(C)C
InChIInChI=1S/C6H13BrOSi/c1-6(5-7)8-9(2,3)4/h1,5H2,2-4H3
InChIKeyTWJWSRPQKFAOLD-UHFFFAOYSA-N
MW209.16 g/mol
LogP2.75
Rot. Bonds3

About 3-bromoprop-1-en-2-yloxy(trimethyl)silane

3-bromoprop-1-en-2-yloxy(trimethyl)silane (PubChem CID 12739597) has the molecular formula C6H13BrOSi and a molecular weight of 209.16 g/mol. Its IUPAC name is 3-bromoprop-1-en-2-yloxy(trimethyl)silane.

Molecular Properties

Compound Name3-bromoprop-1-en-2-yloxy(trimethyl)silane
PubChem CID12739597
Molecular FormulaC6H13BrOSi
Molecular Weight209.16 g/mol
Exact Mass207.99
IUPAC Name3-bromoprop-1-en-2-yloxy(trimethyl)silane
SMILESC=C(CBr)O[Si](C)(C)C
InChIInChI=1S/C6H13BrOSi/c1-6(5-7)8-9(2,3)4/h1,5H2,2-4H3
InChIKeyTWJWSRPQKFAOLD-UHFFFAOYSA-N
XLogP2.75
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.16
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-bromoprop-1-en-2-yloxy(trimethyl)silane?
The IUPAC name of 3-bromoprop-1-en-2-yloxy(trimethyl)silane (CID 12739597) is 3-bromoprop-1-en-2-yloxy(trimethyl)silane.
What is the SMILES notation for 3-bromoprop-1-en-2-yloxy(trimethyl)silane?
The canonical SMILES for 3-bromoprop-1-en-2-yloxy(trimethyl)silane is C=C(CBr)O[Si](C)(C)C.
What is the InChIKey of 3-bromoprop-1-en-2-yloxy(trimethyl)silane?
The InChIKey is TWJWSRPQKFAOLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13BrOSi/c1-6(5-7)8-9(2,3)4/h1,5H2,2-4H3.
What are the key properties of 3-bromoprop-1-en-2-yloxy(trimethyl)silane?
3-bromoprop-1-en-2-yloxy(trimethyl)silane has a molecular weight of 209.16 g/mol, XLogP of 2.75, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromoprop-1-en-2-yloxy(trimethyl)silane is sourced from PubChem (CID 12739597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).