trichloro(3-methylbut-1-en-2-yloxy)silane

C5H9Cl3OSi — CID 10846540

IUPACtrichloro(3-methylbut-1-en-2-yloxy)silane
SMILESC=C(O[Si](Cl)(Cl)Cl)C(C)C
InChIInChI=1S/C5H9Cl3OSi/c1-4(2)5(3)9-10(6,7)8/h4H,3H2,1-2H3
InChIKeyUKGPOAPCPILQTF-UHFFFAOYSA-N
MW219.57 g/mol
LogP3.32
Rot. Bonds3

About trichloro(3-methylbut-1-en-2-yloxy)silane

trichloro(3-methylbut-1-en-2-yloxy)silane (PubChem CID 10846540) has the molecular formula C5H9Cl3OSi and a molecular weight of 219.57 g/mol. Its IUPAC name is trichloro(3-methylbut-1-en-2-yloxy)silane.

Molecular Properties

Compound Nametrichloro(3-methylbut-1-en-2-yloxy)silane
PubChem CID10846540
Molecular FormulaC5H9Cl3OSi
Molecular Weight219.57 g/mol
Exact Mass217.95
IUPAC Nametrichloro(3-methylbut-1-en-2-yloxy)silane
SMILESC=C(O[Si](Cl)(Cl)Cl)C(C)C
InChIInChI=1S/C5H9Cl3OSi/c1-4(2)5(3)9-10(6,7)8/h4H,3H2,1-2H3
InChIKeyUKGPOAPCPILQTF-UHFFFAOYSA-N
XLogP3.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.57
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[(2R)-3-trichlorosilyloxybut-3-en-2-yl] 2,2-dimethylpropanoate
CID 10780938
2-methoxy-3-methylbut-1-ene;molecular hydrogen
CID 159874902
[dimethyl(3-methylbut-1-en-2-yloxy)silyl] trifluoromethanesulfonate
CID 10266340
chloro-methyl-bis(prop-1-en-2-yloxy)silane
CID 87112629
1-chloroethenoxy(trimethyl)silane
CID 175502754
2-fluoro-3-(3-fluorobut-3-en-2-yloxy)but-1-ene
CID 138505671
[(1Z)-1,3-dimethoxy-2-propan-2-ylbuta-1,3-dienoxy]-trimethylsilane
CID 11032120
3-methylbut-1-en-2-yloxycyclohexane;molecular hydrogen
CID 162020896
2,3-dimethylbutane;bis(2,3-dimethylbut-1-ene)
CID 158413804
5-chloro-2-(5-chloro-3-methylpent-1-en-2-yl)oxy-3-methylpent-1-ene
CID 21321784
chloro-dimethyl-(2-methylprop-2-enyl)silane
CID 11355567
1-chloro-1-(1-chloroethenoxy)ethane
CID 89186659

Frequently Asked Questions

What is the IUPAC name of trichloro(3-methylbut-1-en-2-yloxy)silane?
The IUPAC name of trichloro(3-methylbut-1-en-2-yloxy)silane (CID 10846540) is trichloro(3-methylbut-1-en-2-yloxy)silane.
What is the SMILES notation for trichloro(3-methylbut-1-en-2-yloxy)silane?
The canonical SMILES for trichloro(3-methylbut-1-en-2-yloxy)silane is C=C(O[Si](Cl)(Cl)Cl)C(C)C.
What is the InChIKey of trichloro(3-methylbut-1-en-2-yloxy)silane?
The InChIKey is UKGPOAPCPILQTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9Cl3OSi/c1-4(2)5(3)9-10(6,7)8/h4H,3H2,1-2H3.
What are the key properties of trichloro(3-methylbut-1-en-2-yloxy)silane?
trichloro(3-methylbut-1-en-2-yloxy)silane has a molecular weight of 219.57 g/mol, XLogP of 3.32, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro(3-methylbut-1-en-2-yloxy)silane is sourced from PubChem (CID 10846540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).