6-chlorohexan-2-yloxysilane

C6H15ClOSi — CID 173272103

IUPAC6-chlorohexan-2-yloxysilane
SMILESCC(CCCCCl)O[SiH3]
InChIInChI=1S/C6H15ClOSi/c1-6(8-9)4-2-3-5-7/h6H,2-5H2,1,9H3
InChIKeyHYNDRHVGCWFZEG-UHFFFAOYSA-N
MW166.72 g/mol
LogP1.08
Rot. Bonds5

About 6-chlorohexan-2-yloxysilane

6-chlorohexan-2-yloxysilane (PubChem CID 173272103) has the molecular formula C6H15ClOSi and a molecular weight of 166.72 g/mol. Its IUPAC name is 6-chlorohexan-2-yloxysilane.

Molecular Properties

Compound Name6-chlorohexan-2-yloxysilane
PubChem CID173272103
Molecular FormulaC6H15ClOSi
Molecular Weight166.72 g/mol
Exact Mass166.06
IUPAC Name6-chlorohexan-2-yloxysilane
SMILESCC(CCCCCl)O[SiH3]
InChIInChI=1S/C6H15ClOSi/c1-6(8-9)4-2-3-5-7/h6H,2-5H2,1,9H3
InChIKeyHYNDRHVGCWFZEG-UHFFFAOYSA-N
XLogP1.08
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.72
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

tetradecan-2-yloxysilane
CID 173015270
1-chloropropan-2-yloxysilane
CID 173192106
1,7-dichloro-3-methylheptane
CID 175072872
1-chloro-4-ethoxypentane
CID 90797429
1,8-dichloro-2-methyloctane
CID 154320293
10-chlorodecan-2-ol
CID 139625659
(2R)-9-chlorononan-2-ol
CID 139766902
5-methylnonan-2-yloxysilane
CID 174485634
1,6-dichloro-5,6-dimethylheptane
CID 150904715
(2S)-8-chloro-2-methyloctan-1-ol
CID 139766830
(3S)-7-chloro-3-methylheptan-1-ol
CID 139766847
1,7-dichloro-4-methylheptane
CID 175347315

Frequently Asked Questions

What is the IUPAC name of 6-chlorohexan-2-yloxysilane?
The IUPAC name of 6-chlorohexan-2-yloxysilane (CID 173272103) is 6-chlorohexan-2-yloxysilane.
What is the SMILES notation for 6-chlorohexan-2-yloxysilane?
The canonical SMILES for 6-chlorohexan-2-yloxysilane is CC(CCCCCl)O[SiH3].
What is the InChIKey of 6-chlorohexan-2-yloxysilane?
The InChIKey is HYNDRHVGCWFZEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15ClOSi/c1-6(8-9)4-2-3-5-7/h6H,2-5H2,1,9H3.
What are the key properties of 6-chlorohexan-2-yloxysilane?
6-chlorohexan-2-yloxysilane has a molecular weight of 166.72 g/mol, XLogP of 1.08, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chlorohexan-2-yloxysilane is sourced from PubChem (CID 173272103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).