tert-butyl-(2-tert-butylbenzene-4-id-1-yl)oxy-dimethylsilane;chlorozinc(1+)

C16H27ClOSiZn — CID 10666447

IUPACtert-butyl-(2-tert-butylbenzene-4-id-1-yl)oxy-dimethylsilane;chlorozinc(1+)
SMILESCC(C)(C)c1c[c-]ccc1O[Si](C)(C)C(C)(C)C.Cl[Zn+]
InChIInChI=1S/C16H27OSi.ClH.Zn/c1-15(2,3)13-11-9-10-12-14(13)17-18(7,8)16(4,5)6;;/h10-12H,1-8H3;1H;/q-1;;+2/p-1
InChIKeyAMLMQYIDYKVZMH-UHFFFAOYSA-M
MW364.32 g/mol
LogP5.86
Rot. Bonds2

About tert-butyl-(2-tert-butylbenzene-4-id-1-yl)oxy-dimethylsilane;chlorozinc(1+)

tert-butyl-(2-tert-butylbenzene-4-id-1-yl)oxy-dimethylsilane;chlorozinc(1+) (PubChem CID 10666447) has the molecular formula C16H27ClOSiZn and a molecular weight of 364.32 g/mol. Its IUPAC name is tert-butyl-(2-tert-butylbenzene-4-id-1-yl)oxy-dimethylsilane;chlorozinc(1+).

Molecular Properties

Compound Nametert-butyl-(2-tert-butylbenzene-4-id-1-yl)oxy-dimethylsilane;chlorozinc(1+)
PubChem CID10666447
Molecular FormulaC16H27ClOSiZn
Molecular Weight364.32 g/mol
Exact Mass362.08
IUPAC Nametert-butyl-(2-tert-butylbenzene-4-id-1-yl)oxy-dimethylsilane;chlorozinc(1+)
SMILESCC(C)(C)c1c[c-]ccc1O[Si](C)(C)C(C)(C)C.Cl[Zn+]
InChIInChI=1S/C16H27OSi.ClH.Zn/c1-15(2,3)13-11-9-10-12-14(13)17-18(7,8)16(4,5)6;;/h10-12H,1-8H3;1H;/q-1;;+2/p-1
InChIKeyAMLMQYIDYKVZMH-UHFFFAOYSA-M
XLogP5.86
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.32
LogP ≤ 55.86
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 tert-butyl-(2-tert-butylbenzene-4-id-1-yl)oxy-dimethylsilane;chlorozinc(1+)?
The IUPAC name of tert-butyl-(2-tert-butylbenzene-4-id-1-yl)oxy-dimethylsilane;chlorozinc(1+) (CID 10666447) is tert-butyl-(2-tert-butylbenzene-4-id-1-yl)oxy-dimethylsilane;chlorozinc(1+).
What is the SMILES notation for tert-butyl-(2-tert-butylbenzene-4-id-1-yl)oxy-dimethylsilane;chlorozinc(1+)?
The canonical SMILES for tert-butyl-(2-tert-butylbenzene-4-id-1-yl)oxy-dimethylsilane;chlorozinc(1+) is CC(C)(C)c1c[c-]ccc1O[Si](C)(C)C(C)(C)C.Cl[Zn+].
What is the InChIKey of tert-butyl-(2-tert-butylbenzene-4-id-1-yl)oxy-dimethylsilane;chlorozinc(1+)?
The InChIKey is AMLMQYIDYKVZMH-UHFFFAOYSA-M. The full InChI is InChI=1S/C16H27OSi.ClH.Zn/c1-15(2,3)13-11-9-10-12-14(13)17-18(7,8)16(4,5)6;;/h10-12H,1-8H3;1H;/q-1;;+2/p-1.
What are the key properties of tert-butyl-(2-tert-butylbenzene-4-id-1-yl)oxy-dimethylsilane;chlorozinc(1+)?
tert-butyl-(2-tert-butylbenzene-4-id-1-yl)oxy-dimethylsilane;chlorozinc(1+) has a molecular weight of 364.32 g/mol, XLogP of 5.86, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(2-tert-butylbenzene-4-id-1-yl)oxy-dimethylsilane;chlorozinc(1+) is sourced from PubChem (CID 10666447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).