trimethyl-[(Z)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-2-en-3-yl]silane

C16H33BO2Si — CID 132837840

IUPACtrimethyl-[(Z)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-2-en-3-yl]silane
SMILESCCCC/C(=C/CB1OC(C)(C)C(C)(C)O1)[Si](C)(C)C
InChIInChI=1S/C16H33BO2Si/c1-9-10-11-14(20(6,7)8)12-13-17-18-15(2,3)16(4,5)19-17/h12H,9-11,13H2,1-8H3/b14-12-
InChIKeyONYYLYJJZKYCAO-OWBHPGMISA-N
MW296.34 g/mol
LogP5.07
Rot. Bonds6

About trimethyl-[(Z)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-2-en-3-yl]silane

trimethyl-[(Z)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-2-en-3-yl]silane (PubChem CID 132837840) has the molecular formula C16H33BO2Si and a molecular weight of 296.34 g/mol. Its IUPAC name is trimethyl-[(Z)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-2-en-3-yl]silane.

Molecular Properties

Compound Nametrimethyl-[(Z)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-2-en-3-yl]silane
PubChem CID132837840
Molecular FormulaC16H33BO2Si
Molecular Weight296.34 g/mol
Exact Mass296.23
IUPAC Nametrimethyl-[(Z)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-2-en-3-yl]silane
SMILESCCCC/C(=C/CB1OC(C)(C)C(C)(C)O1)[Si](C)(C)C
InChIInChI=1S/C16H33BO2Si/c1-9-10-11-14(20(6,7)8)12-13-17-18-15(2,3)16(4,5)19-17/h12H,9-11,13H2,1-8H3/b14-12-
InChIKeyONYYLYJJZKYCAO-OWBHPGMISA-N
XLogP5.07
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.34
LogP ≤ 55.07
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

2-[(Z)-dodec-6-en-6-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 149059896
2-[(E)-dec-5-en-5-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 140735208
4,4,5,5-tetramethyl-2-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]-1,3,2-dioxaborolane
CID 52952325
2-[(2R,5E)-6,10-dimethylundeca-5,9-dien-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 59052617
(E)-4,4,5,5-tetramethyl-2-(2,5,9-trimethyldeca-4,8-dien-3-yl)-1,3,2-dioxaborolane
CID 101043870
tri(propan-2-yl)-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)but-2-enyl]silane
CID 101350024
dimethyl-propan-2-yloxy-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hex-2-enyl]silane
CID 101555549
2-[(Z)-dec-5-en-5-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 102231868
methoxydimethyl((2S,3R)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-6-en-3-yl)silane
CID 124221683
tri(propan-2-yl)-[(E)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)but-2-enyl]silane
CID 134904097
4,4,5,5-tetramethyl-2-[(2E,5E)-3,6,10-trimethylundeca-2,5,9-trien-2-yl]-1,3,2-dioxaborolane
CID 154715581
tert-butyl-[(2Z,4E)-5,9-dimethyl-2-[1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethylidene]deca-4,8-dienoxy]-dimethylsilane
CID 154715582

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(Z)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-2-en-3-yl]silane?
The IUPAC name of trimethyl-[(Z)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-2-en-3-yl]silane (CID 132837840) is trimethyl-[(Z)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-2-en-3-yl]silane.
What is the SMILES notation for trimethyl-[(Z)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-2-en-3-yl]silane?
The canonical SMILES for trimethyl-[(Z)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-2-en-3-yl]silane is CCCC/C(=C/CB1OC(C)(C)C(C)(C)O1)[Si](C)(C)C.
What is the InChIKey of trimethyl-[(Z)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-2-en-3-yl]silane?
The InChIKey is ONYYLYJJZKYCAO-OWBHPGMISA-N. The full InChI is InChI=1S/C16H33BO2Si/c1-9-10-11-14(20(6,7)8)12-13-17-18-15(2,3)16(4,5)19-17/h12H,9-11,13H2,1-8H3/b14-12-.
What are the key properties of trimethyl-[(Z)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-2-en-3-yl]silane?
trimethyl-[(Z)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-2-en-3-yl]silane has a molecular weight of 296.34 g/mol, XLogP of 5.07, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(Z)-1-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)hept-2-en-3-yl]silane is sourced from PubChem (CID 132837840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).