bromozinc(1+);tert-butyl-dimethyl-[(3-trimethylsilyloxycyclopenten-1-yl)methoxy]silane

C15H31BrO2Si2Zn — CID 134887389

IUPACbromozinc(1+);tert-butyl-dimethyl-[(3-trimethylsilyloxycyclopenten-1-yl)methoxy]silane
SMILESCC(C)(C)[Si](C)(C)OCC1=[C-]C(O[Si](C)(C)C)CC1.[Zn+]Br
InChIInChI=1S/C15H31O2Si2.BrH.Zn/c1-15(2,3)19(7,8)16-12-13-9-10-14(11-13)17-18(4,5)6;;/h14H,9-10,12H2,1-8H3;1H;/q-1;;+2/p-1
InChIKeyCBKUPYPOBZSMJC-UHFFFAOYSA-M
MW444.88 g/mol
LogP5.59
Rot. Bonds5

About bromozinc(1+);tert-butyl-dimethyl-[(3-trimethylsilyloxycyclopenten-1-yl)methoxy]silane

bromozinc(1+);tert-butyl-dimethyl-[(3-trimethylsilyloxycyclopenten-1-yl)methoxy]silane (PubChem CID 134887389) has the molecular formula C15H31BrO2Si2Zn and a molecular weight of 444.88 g/mol. Its IUPAC name is bromozinc(1+);tert-butyl-dimethyl-[(3-trimethylsilyloxycyclopenten-1-yl)methoxy]silane.

Molecular Properties

Compound Namebromozinc(1+);tert-butyl-dimethyl-[(3-trimethylsilyloxycyclopenten-1-yl)methoxy]silane
PubChem CID134887389
Molecular FormulaC15H31BrO2Si2Zn
Molecular Weight444.88 g/mol
Exact Mass442.03
IUPAC Namebromozinc(1+);tert-butyl-dimethyl-[(3-trimethylsilyloxycyclopenten-1-yl)methoxy]silane
SMILESCC(C)(C)[Si](C)(C)OCC1=[C-]C(O[Si](C)(C)C)CC1.[Zn+]Br
InChIInChI=1S/C15H31O2Si2.BrH.Zn/c1-15(2,3)19(7,8)16-12-13-9-10-14(11-13)17-18(4,5)6;;/h14H,9-10,12H2,1-8H3;1H;/q-1;;+2/p-1
InChIKeyCBKUPYPOBZSMJC-UHFFFAOYSA-M
XLogP5.59
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500444.88
LogP ≤ 55.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Tert-butyl-[(2-iodo-3-trimethylsilyloxycyclopenten-1-yl)methoxy]-dimethylsilane
CID 10895200
[(3R,5S)-3,5-bis[[tert-butyl(dimethyl)silyl]oxy]cyclopenten-1-yl]methoxy-tert-butyl-dimethylsilane
CID 11091949
Tert-butyl-dimethyl-(2-methyl-3-trimethylsilyloxycyclopent-2-en-1-yl)oxysilane
CID 102435319
Tert-butyl-dimethyl-[(3-trimethylsilyloxycyclopenten-1-yl)methoxy]silane
CID 134887390

Frequently Asked Questions

What is the IUPAC name of bromozinc(1+);tert-butyl-dimethyl-[(3-trimethylsilyloxycyclopenten-1-yl)methoxy]silane?
The IUPAC name of bromozinc(1+);tert-butyl-dimethyl-[(3-trimethylsilyloxycyclopenten-1-yl)methoxy]silane (CID 134887389) is bromozinc(1+);tert-butyl-dimethyl-[(3-trimethylsilyloxycyclopenten-1-yl)methoxy]silane.
What is the SMILES notation for bromozinc(1+);tert-butyl-dimethyl-[(3-trimethylsilyloxycyclopenten-1-yl)methoxy]silane?
The canonical SMILES for bromozinc(1+);tert-butyl-dimethyl-[(3-trimethylsilyloxycyclopenten-1-yl)methoxy]silane is CC(C)(C)[Si](C)(C)OCC1=[C-]C(O[Si](C)(C)C)CC1.[Zn+]Br.
What is the InChIKey of bromozinc(1+);tert-butyl-dimethyl-[(3-trimethylsilyloxycyclopenten-1-yl)methoxy]silane?
The InChIKey is CBKUPYPOBZSMJC-UHFFFAOYSA-M. The full InChI is InChI=1S/C15H31O2Si2.BrH.Zn/c1-15(2,3)19(7,8)16-12-13-9-10-14(11-13)17-18(4,5)6;;/h14H,9-10,12H2,1-8H3;1H;/q-1;;+2/p-1.
What are the key properties of bromozinc(1+);tert-butyl-dimethyl-[(3-trimethylsilyloxycyclopenten-1-yl)methoxy]silane?
bromozinc(1+);tert-butyl-dimethyl-[(3-trimethylsilyloxycyclopenten-1-yl)methoxy]silane has a molecular weight of 444.88 g/mol, XLogP of 5.59, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bromozinc(1+);tert-butyl-dimethyl-[(3-trimethylsilyloxycyclopenten-1-yl)methoxy]silane is sourced from PubChem (CID 134887389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).