but-3-enyl-tert-butyl-methoxysilane

C9H20OSi — CID 154061638

IUPACbut-3-enyl-tert-butyl-methoxysilane
SMILESC=CCC[SiH](OC)C(C)(C)C
InChIInChI=1S/C9H20OSi/c1-6-7-8-11(10-5)9(2,3)4/h6,11H,1,7-8H2,2-5H3
InChIKeyPDOUUHILGYJWBR-UHFFFAOYSA-N
MW172.34 g/mol
LogP2.73
Rot. Bonds4

About but-3-enyl-tert-butyl-methoxysilane

but-3-enyl-tert-butyl-methoxysilane (PubChem CID 154061638) has the molecular formula C9H20OSi and a molecular weight of 172.34 g/mol. Its IUPAC name is but-3-enyl-tert-butyl-methoxysilane.

Molecular Properties

Compound Namebut-3-enyl-tert-butyl-methoxysilane
PubChem CID154061638
Molecular FormulaC9H20OSi
Molecular Weight172.34 g/mol
Exact Mass172.13
IUPAC Namebut-3-enyl-tert-butyl-methoxysilane
SMILESC=CCC[SiH](OC)C(C)(C)C
InChIInChI=1S/C9H20OSi/c1-6-7-8-11(10-5)9(2,3)4/h6,11H,1,7-8H2,2-5H3
InChIKeyPDOUUHILGYJWBR-UHFFFAOYSA-N
XLogP2.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.34
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

but-3-enoxy(ditert-butyl)silane
CID 123806243
dimethoxy(non-8-enyl)silane
CID 173096526
hexadec-15-enyl(dimethoxy)silane
CID 172819817
but-1-ene;trimethoxysilane
CID 162022508
but-3-enyl-bis(1-methoxyethoxy)silane
CID 173068738
5-methoxy-5,6-dimethylhept-1-ene
CID 23385174
pent-4-enyl 2-iodo-2-methylpropanoate
CID 11129735
methoxymethane;tridec-12-en-1-ol
CID 87674016
3-(bromomethyl)-3-methylhepta-1,6-diene
CID 165447101
(5E)-5-methoxyhepta-1,5-diene
CID 88979708
2,3-dimethyl-3-pent-4-enoxybutan-2-ol
CID 175216620
4-ethoxybut-1-ene
CID 533994

Frequently Asked Questions

What is the IUPAC name of but-3-enyl-tert-butyl-methoxysilane?
The IUPAC name of but-3-enyl-tert-butyl-methoxysilane (CID 154061638) is but-3-enyl-tert-butyl-methoxysilane.
What is the SMILES notation for but-3-enyl-tert-butyl-methoxysilane?
The canonical SMILES for but-3-enyl-tert-butyl-methoxysilane is C=CCC[SiH](OC)C(C)(C)C.
What is the InChIKey of but-3-enyl-tert-butyl-methoxysilane?
The InChIKey is PDOUUHILGYJWBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20OSi/c1-6-7-8-11(10-5)9(2,3)4/h6,11H,1,7-8H2,2-5H3.
What are the key properties of but-3-enyl-tert-butyl-methoxysilane?
but-3-enyl-tert-butyl-methoxysilane has a molecular weight of 172.34 g/mol, XLogP of 2.73, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for but-3-enyl-tert-butyl-methoxysilane is sourced from PubChem (CID 154061638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).