chloro-(3-methyl-2-propan-2-ylbut-1-enyl)silane

C8H17ClSi — CID 154252206

IUPACchloro-(3-methyl-2-propan-2-ylbut-1-enyl)silane
SMILESCC(C)C(=C[SiH2]Cl)C(C)C
InChIInChI=1S/C8H17ClSi/c1-6(2)8(5-10-9)7(3)4/h5-7H,10H2,1-4H3
InChIKeyBSACJNFKJLTORU-UHFFFAOYSA-N
MW176.76 g/mol
LogP2.50
Rot. Bonds3

About chloro-(3-methyl-2-propan-2-ylbut-1-enyl)silane

chloro-(3-methyl-2-propan-2-ylbut-1-enyl)silane (PubChem CID 154252206) has the molecular formula C8H17ClSi and a molecular weight of 176.76 g/mol. Its IUPAC name is chloro-(3-methyl-2-propan-2-ylbut-1-enyl)silane.

Molecular Properties

Compound Namechloro-(3-methyl-2-propan-2-ylbut-1-enyl)silane
PubChem CID154252206
Molecular FormulaC8H17ClSi
Molecular Weight176.76 g/mol
Exact Mass176.08
IUPAC Namechloro-(3-methyl-2-propan-2-ylbut-1-enyl)silane
SMILESCC(C)C(=C[SiH2]Cl)C(C)C
InChIInChI=1S/C8H17ClSi/c1-6(2)8(5-10-9)7(3)4/h5-7H,10H2,1-4H3
InChIKeyBSACJNFKJLTORU-UHFFFAOYSA-N
XLogP2.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.76
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloro-(3-methyl-2-propan-2-ylbut-1-enyl)silane?
The IUPAC name of chloro-(3-methyl-2-propan-2-ylbut-1-enyl)silane (CID 154252206) is chloro-(3-methyl-2-propan-2-ylbut-1-enyl)silane.
What is the SMILES notation for chloro-(3-methyl-2-propan-2-ylbut-1-enyl)silane?
The canonical SMILES for chloro-(3-methyl-2-propan-2-ylbut-1-enyl)silane is CC(C)C(=C[SiH2]Cl)C(C)C.
What is the InChIKey of chloro-(3-methyl-2-propan-2-ylbut-1-enyl)silane?
The InChIKey is BSACJNFKJLTORU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17ClSi/c1-6(2)8(5-10-9)7(3)4/h5-7H,10H2,1-4H3.
What are the key properties of chloro-(3-methyl-2-propan-2-ylbut-1-enyl)silane?
chloro-(3-methyl-2-propan-2-ylbut-1-enyl)silane has a molecular weight of 176.76 g/mol, XLogP of 2.50, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(3-methyl-2-propan-2-ylbut-1-enyl)silane is sourced from PubChem (CID 154252206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).