iodozinc(1+);2-methylbutane

C5H11IZn — CID 142317299

IUPACiodozinc(1+);2-methylbutane
SMILESC[CH-]C(C)C.[Zn+]I
InChIInChI=1S/C5H11.HI.Zn/c1-4-5(2)3;;/h4-5H,1-3H3;1H;/q-1;;+2/p-1
InChIKeyLOGLLGRKBMUOCD-UHFFFAOYSA-M
MW263.44 g/mol
LogP2.75
Rot. Bonds1

About iodozinc(1+);2-methylbutane

iodozinc(1+);2-methylbutane (PubChem CID 142317299) has the molecular formula C5H11IZn and a molecular weight of 263.44 g/mol. Its IUPAC name is iodozinc(1+);2-methylbutane.

Molecular Properties

Compound Nameiodozinc(1+);2-methylbutane
PubChem CID142317299
Molecular FormulaC5H11IZn
Molecular Weight263.44 g/mol
Exact Mass261.92
IUPAC Nameiodozinc(1+);2-methylbutane
SMILESC[CH-]C(C)C.[Zn+]I
InChIInChI=1S/C5H11.HI.Zn/c1-4-5(2)3;;/h4-5H,1-3H3;1H;/q-1;;+2/p-1
InChIKeyLOGLLGRKBMUOCD-UHFFFAOYSA-M
XLogP2.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.44
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-methylbutane;zinc
CID 174944394
iodozinc(1+);propane
CID 11390696
carbanide;(3R,4S)-3,4-dimethylhexane;bis(yttrium);yttrium(3+)
CID 177285354
methane;2-methylpropane;propane;yttrium
CID 162183539
lanthanum;propane;propan-2-ol
CID 148548926
carbanide;3-methylpentane;zirconium(3+)
CID 23519259
CID 159482999
CID 159482999
ethane;3-methylpentane;tungsten(2+)
CID 161154116
2-iodopropane;hydrofluoride
CID 22016180
CID 172710432
CID 172710432
iodosilver;2-methylbutane
CID 174297027
2,3-dimethylpentylsilane
CID 123335817

Frequently Asked Questions

What is the IUPAC name of iodozinc(1+);2-methylbutane?
The IUPAC name of iodozinc(1+);2-methylbutane (CID 142317299) is iodozinc(1+);2-methylbutane.
What is the SMILES notation for iodozinc(1+);2-methylbutane?
The canonical SMILES for iodozinc(1+);2-methylbutane is C[CH-]C(C)C.[Zn+]I.
What is the InChIKey of iodozinc(1+);2-methylbutane?
The InChIKey is LOGLLGRKBMUOCD-UHFFFAOYSA-M. The full InChI is InChI=1S/C5H11.HI.Zn/c1-4-5(2)3;;/h4-5H,1-3H3;1H;/q-1;;+2/p-1.
What are the key properties of iodozinc(1+);2-methylbutane?
iodozinc(1+);2-methylbutane has a molecular weight of 263.44 g/mol, XLogP of 2.75, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for iodozinc(1+);2-methylbutane is sourced from PubChem (CID 142317299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).