dimethyl-propan-2-yloxy-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-enyl]silane

C17H35BO3Si — CID 154711240

IUPACdimethyl-propan-2-yloxy-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-enyl]silane
SMILESCCCC/C(=C/[Si](C)(C)OC(C)C)B1OC(C)(C)C(C)(C)O1
InChIInChI=1S/C17H35BO3Si/c1-10-11-12-15(13-22(8,9)19-14(2)3)18-20-16(4,5)17(6,7)21-18/h13-14H,10-12H2,1-9H3/b15-13-
InChIKeyRNTKZQNVKWLMLT-SQFISAMPSA-N
MW326.36 g/mol
LogP4.90
Rot. Bonds7

About dimethyl-propan-2-yloxy-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-enyl]silane

dimethyl-propan-2-yloxy-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-enyl]silane (PubChem CID 154711240) has the molecular formula C17H35BO3Si and a molecular weight of 326.36 g/mol. Its IUPAC name is dimethyl-propan-2-yloxy-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-enyl]silane.

Molecular Properties

Compound Namedimethyl-propan-2-yloxy-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-enyl]silane
PubChem CID154711240
Molecular FormulaC17H35BO3Si
Molecular Weight326.36 g/mol
Exact Mass326.24
IUPAC Namedimethyl-propan-2-yloxy-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-enyl]silane
SMILESCCCC/C(=C/[Si](C)(C)OC(C)C)B1OC(C)(C)C(C)(C)O1
InChIInChI=1S/C17H35BO3Si/c1-10-11-12-15(13-22(8,9)19-14(2)3)18-20-16(4,5)17(6,7)21-18/h13-14H,10-12H2,1-9H3/b15-13-
InChIKeyRNTKZQNVKWLMLT-SQFISAMPSA-N
XLogP4.90
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.36
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(E)-tert-Butyldimethyl((4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)but-3-en-1-yl)oxy)silane
CID 16217344
(E)-tert-Butyldimethyl((4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)but-3-en-2-yl)oxy)silane
CID 11688192
tert-butyl-dimethyl-[(Z)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-enoxy]silane
CID 9973646
tert-Butyldimethyl((3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)but-3-en-1-yl)oxy)silane
CID 11347477
(E)-Tert-butyldimethyl((5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)pent-4-EN-1-YL)oxy)silane
CID 11851250
[(3R)-3,4-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-enoxy]-tert-butyl-dimethylsilane
CID 16750756
tert-butyl-dimethyl-[(4S)-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-5-enoxy]silane
CID 24754553
tert-butyl-[(E)-4-[dimethyl(propan-2-yloxy)silyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-enoxy]-dimethylsilane
CID 24850804
(E)-5-[dimethyl(propan-2-yloxy)silyl]-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-5-enenitrile
CID 24850805
tert-butyl-[(E)-4-[dimethyl(propan-2-yloxy)silyl]-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)but-3-enoxy]-dimethylsilane
CID 49765288
(E)-6-[dimethyl(propan-2-yloxy)silyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-5-enenitrile
CID 56945596
lithium tert-butyl-[(E)-5-(2-tert-butyl-4,4,5,5-tetramethyl-1,3-dioxa-2-boranuidacyclopent-2-yl)pent-4-enoxy]-dimethylsilane
CID 57332414

Frequently Asked Questions

What is the IUPAC name of dimethyl-propan-2-yloxy-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-enyl]silane?
The IUPAC name of dimethyl-propan-2-yloxy-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-enyl]silane (CID 154711240) is dimethyl-propan-2-yloxy-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-enyl]silane.
What is the SMILES notation for dimethyl-propan-2-yloxy-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-enyl]silane?
The canonical SMILES for dimethyl-propan-2-yloxy-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-enyl]silane is CCCC/C(=C/[Si](C)(C)OC(C)C)B1OC(C)(C)C(C)(C)O1.
What is the InChIKey of dimethyl-propan-2-yloxy-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-enyl]silane?
The InChIKey is RNTKZQNVKWLMLT-SQFISAMPSA-N. The full InChI is InChI=1S/C17H35BO3Si/c1-10-11-12-15(13-22(8,9)19-14(2)3)18-20-16(4,5)17(6,7)21-18/h13-14H,10-12H2,1-9H3/b15-13-.
What are the key properties of dimethyl-propan-2-yloxy-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-enyl]silane?
dimethyl-propan-2-yloxy-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-enyl]silane has a molecular weight of 326.36 g/mol, XLogP of 4.90, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-propan-2-yloxy-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-1-enyl]silane is sourced from PubChem (CID 154711240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).