tert-butyl-[(3R)-1-iodopentan-3-yl]oxy-dimethylsilane

C11H25IOSi — CID 15939181

IUPACtert-butyl-[(3R)-1-iodopentan-3-yl]oxy-dimethylsilane
SMILESCC[C@H](CCI)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H25IOSi/c1-7-10(8-9-12)13-14(5,6)11(2,3)4/h10H,7-9H2,1-6H3/t10-/m1/s1
InChIKeyHGNBQBIGYCSWOW-SNVBAGLBSA-N
MW328.31 g/mol
LogP4.61
Rot. Bonds5

About tert-butyl-[(3R)-1-iodopentan-3-yl]oxy-dimethylsilane

tert-butyl-[(3R)-1-iodopentan-3-yl]oxy-dimethylsilane (PubChem CID 15939181) has the molecular formula C11H25IOSi and a molecular weight of 328.31 g/mol. Its IUPAC name is tert-butyl-[(3R)-1-iodopentan-3-yl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(3R)-1-iodopentan-3-yl]oxy-dimethylsilane
PubChem CID15939181
Molecular FormulaC11H25IOSi
Molecular Weight328.31 g/mol
Exact Mass328.07
IUPAC Nametert-butyl-[(3R)-1-iodopentan-3-yl]oxy-dimethylsilane
SMILESCC[C@H](CCI)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H25IOSi/c1-7-10(8-9-12)13-14(5,6)11(2,3)4/h10H,7-9H2,1-6H3/t10-/m1/s1
InChIKeyHGNBQBIGYCSWOW-SNVBAGLBSA-N
XLogP4.61
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.31
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-[(3R)-1-iododecan-3-yl]oxy-dimethylsilane
CID 140734279
(3R)-3-[tert-butyl(dimethyl)silyl]oxypentan-1-ol
CID 10900101
tert-butyl-dimethyl-pentan-3-yloxysilane;molecular hydrogen
CID 175100098
tert-butyl-[(2R)-1-[(2R,3S)-3-(iodomethyl)oxiran-2-yl]butan-2-yl]oxy-dimethylsilane
CID 102051822
tert-butyl-[(2S)-4-iodobutan-2-yl]oxy-dimethylsilane
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tert-butyl-(4-iodobutan-2-yloxy)-dimethylsilane
CID 11130810
(5S)-5-[tert-butyl(dimethyl)silyl]oxyheptanal
CID 11021146
tert-butyl-[(3S)-1-[tert-butyl(dimethyl)silyl]oxy-6-iodohexan-3-yl]oxy-dimethylsilane
CID 11102782
tert-butyl-(1-iodopentan-3-yloxy)-diphenylsilane
CID 11080903
tert-butyl-dimethyl-oct-5-yn-3-yloxysilane
CID 88749377
tert-butyl-[(3R)-5-iodo-3-methoxypentoxy]-dimethylsilane
CID 10498589
tert-butyl-(5-iodo-2-methylpent-1-en-3-yl)oxy-dimethylsilane
CID 53392287

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(3R)-1-iodopentan-3-yl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[(3R)-1-iodopentan-3-yl]oxy-dimethylsilane (CID 15939181) is tert-butyl-[(3R)-1-iodopentan-3-yl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[(3R)-1-iodopentan-3-yl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[(3R)-1-iodopentan-3-yl]oxy-dimethylsilane is CC[C@H](CCI)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(3R)-1-iodopentan-3-yl]oxy-dimethylsilane?
The InChIKey is HGNBQBIGYCSWOW-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H25IOSi/c1-7-10(8-9-12)13-14(5,6)11(2,3)4/h10H,7-9H2,1-6H3/t10-/m1/s1.
What are the key properties of tert-butyl-[(3R)-1-iodopentan-3-yl]oxy-dimethylsilane?
tert-butyl-[(3R)-1-iodopentan-3-yl]oxy-dimethylsilane has a molecular weight of 328.31 g/mol, XLogP of 4.61, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(3R)-1-iodopentan-3-yl]oxy-dimethylsilane is sourced from PubChem (CID 15939181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).