bromozinc(1+);tert-butyl-dimethyl-[(2R)-2-methylpent-3-enoxy]silane

C12H25BrOSiZn — CID 134886773

IUPACbromozinc(1+);tert-butyl-dimethyl-[(2R)-2-methylpent-3-enoxy]silane
SMILESC/[C-]=C\[C@@H](C)CO[Si](C)(C)C(C)(C)C.[Zn+]Br
InChIInChI=1S/C12H25OSi.BrH.Zn/c1-8-9-11(2)10-13-14(6,7)12(3,4)5;;/h9,11H,10H2,1-7H3;1H;/q-1;;+2/p-1/t11-;;/m1../s1
InChIKeyORYQIVUJFCMGBO-NVJADKKVSA-M
MW358.71 g/mol
LogP4.87
Rot. Bonds4

About bromozinc(1+);tert-butyl-dimethyl-[(2R)-2-methylpent-3-enoxy]silane

bromozinc(1+);tert-butyl-dimethyl-[(2R)-2-methylpent-3-enoxy]silane (PubChem CID 134886773) has the molecular formula C12H25BrOSiZn and a molecular weight of 358.71 g/mol. Its IUPAC name is bromozinc(1+);tert-butyl-dimethyl-[(2R)-2-methylpent-3-enoxy]silane.

Molecular Properties

Compound Namebromozinc(1+);tert-butyl-dimethyl-[(2R)-2-methylpent-3-enoxy]silane
PubChem CID134886773
Molecular FormulaC12H25BrOSiZn
Molecular Weight358.71 g/mol
Exact Mass356.01
IUPAC Namebromozinc(1+);tert-butyl-dimethyl-[(2R)-2-methylpent-3-enoxy]silane
SMILESC/[C-]=C\[C@@H](C)CO[Si](C)(C)C(C)(C)C.[Zn+]Br
InChIInChI=1S/C12H25OSi.BrH.Zn/c1-8-9-11(2)10-13-14(6,7)12(3,4)5;;/h9,11H,10H2,1-7H3;1H;/q-1;;+2/p-1/t11-;;/m1../s1
InChIKeyORYQIVUJFCMGBO-NVJADKKVSA-M
XLogP4.87
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.71
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bromozinc(1+);tert-butyl-dimethyl-[(2R)-2-methylpent-3-enoxy]silane?
The IUPAC name of bromozinc(1+);tert-butyl-dimethyl-[(2R)-2-methylpent-3-enoxy]silane (CID 134886773) is bromozinc(1+);tert-butyl-dimethyl-[(2R)-2-methylpent-3-enoxy]silane.
What is the SMILES notation for bromozinc(1+);tert-butyl-dimethyl-[(2R)-2-methylpent-3-enoxy]silane?
The canonical SMILES for bromozinc(1+);tert-butyl-dimethyl-[(2R)-2-methylpent-3-enoxy]silane is C/[C-]=C\[C@@H](C)CO[Si](C)(C)C(C)(C)C.[Zn+]Br.
What is the InChIKey of bromozinc(1+);tert-butyl-dimethyl-[(2R)-2-methylpent-3-enoxy]silane?
The InChIKey is ORYQIVUJFCMGBO-NVJADKKVSA-M. The full InChI is InChI=1S/C12H25OSi.BrH.Zn/c1-8-9-11(2)10-13-14(6,7)12(3,4)5;;/h9,11H,10H2,1-7H3;1H;/q-1;;+2/p-1/t11-;;/m1../s1.
What are the key properties of bromozinc(1+);tert-butyl-dimethyl-[(2R)-2-methylpent-3-enoxy]silane?
bromozinc(1+);tert-butyl-dimethyl-[(2R)-2-methylpent-3-enoxy]silane has a molecular weight of 358.71 g/mol, XLogP of 4.87, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bromozinc(1+);tert-butyl-dimethyl-[(2R)-2-methylpent-3-enoxy]silane is sourced from PubChem (CID 134886773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).