3-[ethyl(methoxy)boranyl]pent-2-en-2-yl-methoxy-dimethylsilane

C11H25BO2Si — CID 607907

IUPAC3-[ethyl(methoxy)boranyl]pent-2-en-2-yl-methoxy-dimethylsilane
SMILESCCB(OC)C(CC)=C(C)[Si](C)(C)OC
InChIInChI=1S/C11H25BO2Si/c1-8-11(12(9-2)13-4)10(3)15(6,7)14-5/h8-9H2,1-7H3
InChIKeyQGKKYGQLKCJWSC-UHFFFAOYSA-N
MW228.22 g/mol
LogP3.30
Rot. Bonds6

About 3-[ethyl(methoxy)boranyl]pent-2-en-2-yl-methoxy-dimethylsilane

3-[ethyl(methoxy)boranyl]pent-2-en-2-yl-methoxy-dimethylsilane (PubChem CID 607907) has the molecular formula C11H25BO2Si and a molecular weight of 228.22 g/mol. Its IUPAC name is 3-[ethyl(methoxy)boranyl]pent-2-en-2-yl-methoxy-dimethylsilane.

Molecular Properties

Compound Name3-[ethyl(methoxy)boranyl]pent-2-en-2-yl-methoxy-dimethylsilane
PubChem CID607907
Molecular FormulaC11H25BO2Si
Molecular Weight228.22 g/mol
Exact Mass228.17
IUPAC Name3-[ethyl(methoxy)boranyl]pent-2-en-2-yl-methoxy-dimethylsilane
SMILESCCB(OC)C(CC)=C(C)[Si](C)(C)OC
InChIInChI=1S/C11H25BO2Si/c1-8-11(12(9-2)13-4)10(3)15(6,7)14-5/h8-9H2,1-7H3
InChIKeyQGKKYGQLKCJWSC-UHFFFAOYSA-N
XLogP3.30
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.22
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-Oxa-2-sila-5-boracyclopent-3-ene, 4,5-diethyl-2,2,3-trimethyl-
CID 574206
2,6-Diethyl-4,4,5-trimethyl-4h-1,3,4,2-dioxasilaborine
CID 13329733
5-Ethoxy-4-ethyl-2,5-dihydro-2,2,3-trimethyl-1,2,5-oxasilaborole
CID 13329734
1-Oxa-2-sila-5-boracyclopent-3-ene, 2,4,5-triethyl-2,3-dimethyl-
CID 597424
2-Pentene, 3-(methoxyethylboryl)-2-(methoxydimethylsilyl)-, (E)-
CID 5375555
4,5,5-Triethyl-2,2,3-trimethyl-1-oxa-2-sila-5-boranuidacyclopent-3-ene
CID 14868953
2,4,5,5-Tetraethyl-2,3-dimethyl-1-oxa-2-sila-5-boranuidacyclopent-3-ene
CID 14868957
ethoxy-[(E)-3-[ethoxy(ethyl)boranyl]pent-2-en-2-yl]-dimethylsilane
CID 21609171
(3E)-4,5-diethyl-2,2,3-trimethyl-7,8-dihydro-1,6,2,5-dioxasilaborocine
CID 21609174
4,5-Diethyl-2,2,3-trimethyl-7,8-dihydro-1,6,2,5-dioxasilaborocine
CID 73801401

Frequently Asked Questions

What is the IUPAC name of 3-[ethyl(methoxy)boranyl]pent-2-en-2-yl-methoxy-dimethylsilane?
The IUPAC name of 3-[ethyl(methoxy)boranyl]pent-2-en-2-yl-methoxy-dimethylsilane (CID 607907) is 3-[ethyl(methoxy)boranyl]pent-2-en-2-yl-methoxy-dimethylsilane.
What is the SMILES notation for 3-[ethyl(methoxy)boranyl]pent-2-en-2-yl-methoxy-dimethylsilane?
The canonical SMILES for 3-[ethyl(methoxy)boranyl]pent-2-en-2-yl-methoxy-dimethylsilane is CCB(OC)C(CC)=C(C)[Si](C)(C)OC.
What is the InChIKey of 3-[ethyl(methoxy)boranyl]pent-2-en-2-yl-methoxy-dimethylsilane?
The InChIKey is QGKKYGQLKCJWSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25BO2Si/c1-8-11(12(9-2)13-4)10(3)15(6,7)14-5/h8-9H2,1-7H3.
What are the key properties of 3-[ethyl(methoxy)boranyl]pent-2-en-2-yl-methoxy-dimethylsilane?
3-[ethyl(methoxy)boranyl]pent-2-en-2-yl-methoxy-dimethylsilane has a molecular weight of 228.22 g/mol, XLogP of 3.30, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[ethyl(methoxy)boranyl]pent-2-en-2-yl-methoxy-dimethylsilane is sourced from PubChem (CID 607907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).