[(Z)-2,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]-trimethylsilane

C18H36B2O4Si — CID 54762385

IUPAC[(Z)-2,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]-trimethylsilane
SMILESCC1(C)OB(/C=C(\C[Si](C)(C)C)B2OC(C)(C)C(C)(C)O2)OC1(C)C
InChIInChI=1S/C18H36B2O4Si/c1-15(2)16(3,4)22-19(21-15)12-14(13-25(9,10)11)20-23-17(5,6)18(7,8)24-20/h12H,13H2,1-11H3/b14-12+
InChIKeyGRRJHLBKPBVEGI-WYMLVPIESA-N
MW366.19 g/mol
LogP4.51
Rot. Bonds4

About [(Z)-2,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]-trimethylsilane

[(Z)-2,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]-trimethylsilane (PubChem CID 54762385) has the molecular formula C18H36B2O4Si and a molecular weight of 366.19 g/mol. Its IUPAC name is [(Z)-2,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]-trimethylsilane.

Molecular Properties

Compound Name[(Z)-2,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]-trimethylsilane
PubChem CID54762385
Molecular FormulaC18H36B2O4Si
Molecular Weight366.19 g/mol
Exact Mass366.26
IUPAC Name[(Z)-2,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]-trimethylsilane
SMILESCC1(C)OB(/C=C(\C[Si](C)(C)C)B2OC(C)(C)C(C)(C)O2)OC1(C)C
InChIInChI=1S/C18H36B2O4Si/c1-15(2)16(3,4)22-19(21-15)12-14(13-25(9,10)11)20-23-17(5,6)18(7,8)24-20/h12H,13H2,1-11H3/b14-12+
InChIKeyGRRJHLBKPBVEGI-WYMLVPIESA-N
XLogP4.51
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.19
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[(E)-1,2-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]-trimethylsilane
CID 101913732
tri(propan-2-yl)-[(E)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]silane
CID 10914326
[(3R)-3,4-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-enoxy]-tert-butyl-dimethylsilane
CID 16750756
tri(propan-2-yl)-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)but-2-enyl]silane
CID 101350024
2,2-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethyl-trimethylsilane
CID 101792408
tri(propan-2-yl)-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]silane
CID 134904061
tri(propan-2-yl)-[(E)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)but-2-enyl]silane
CID 134904097
[(Z)-1,2-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-4-trimethylsilylbut-1-en-3-ynyl]-trimethylsilane
CID 135049162
[Dimethyl-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propyl]silyl]oxy-dimethyl-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propyl]silane
CID 154712243
Trimethyl-[2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]silane
CID 10198646
[1,2-Bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-trimethylsilylethenyl]-trimethylsilane
CID 123191710
tert-butyl-dimethyl-[(Z)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enoxy]silane;tert-butyl-dimethyl-[(E)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enoxy]silane
CID 161561591

Frequently Asked Questions

What is the IUPAC name of [(Z)-2,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]-trimethylsilane?
The IUPAC name of [(Z)-2,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]-trimethylsilane (CID 54762385) is [(Z)-2,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]-trimethylsilane.
What is the SMILES notation for [(Z)-2,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]-trimethylsilane?
The canonical SMILES for [(Z)-2,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]-trimethylsilane is CC1(C)OB(/C=C(\C[Si](C)(C)C)B2OC(C)(C)C(C)(C)O2)OC1(C)C.
What is the InChIKey of [(Z)-2,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]-trimethylsilane?
The InChIKey is GRRJHLBKPBVEGI-WYMLVPIESA-N. The full InChI is InChI=1S/C18H36B2O4Si/c1-15(2)16(3,4)22-19(21-15)12-14(13-25(9,10)11)20-23-17(5,6)18(7,8)24-20/h12H,13H2,1-11H3/b14-12+.
What are the key properties of [(Z)-2,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]-trimethylsilane?
[(Z)-2,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]-trimethylsilane has a molecular weight of 366.19 g/mol, XLogP of 4.51, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-2,3-bis(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enyl]-trimethylsilane is sourced from PubChem (CID 54762385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).