octoxysilane;dihydrochloride

C8H22Cl2OSi — CID 174511468

IUPACoctoxysilane;dihydrochloride
SMILESCCCCCCCCO[SiH3].Cl.Cl
InChIInChI=1S/C8H20OSi.2ClH/c1-2-3-4-5-6-7-8-9-10;;/h2-8H2,1,10H3;2*1H
InChIKeyQLMNISJSWKVJST-UHFFFAOYSA-N
MW233.25 g/mol
LogP2.49
Rot. Bonds7

About octoxysilane;dihydrochloride

octoxysilane;dihydrochloride (PubChem CID 174511468) has the molecular formula C8H22Cl2OSi and a molecular weight of 233.25 g/mol. Its IUPAC name is octoxysilane;dihydrochloride.

Molecular Properties

Compound Nameoctoxysilane;dihydrochloride
PubChem CID174511468
Molecular FormulaC8H22Cl2OSi
Molecular Weight233.25 g/mol
Exact Mass232.08
IUPAC Nameoctoxysilane;dihydrochloride
SMILESCCCCCCCCO[SiH3].Cl.Cl
InChIInChI=1S/C8H20OSi.2ClH/c1-2-3-4-5-6-7-8-9-10;;/h2-8H2,1,10H3;2*1H
InChIKeyQLMNISJSWKVJST-UHFFFAOYSA-N
XLogP2.49
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.25
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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CID 172747457
icosane;tetrahydrochloride
CID 143212018
bis(heptane);hydrochloride
CID 160833718
decane;ruthenium
CID 160818595
pentacosane;hydrochloride
CID 172714496
nonadecane;hydrochloride
CID 172821128
propoxysilane;trioctylphosphane
CID 175291717
1-dodecoxyhexadecane
CID 22256973
1-decoxydocosane
CID 87077677
dodecylmercury;hydrate
CID 78070234
1-(7-tetradecoxyheptoxy)tetradecane
CID 139884729
1-hexacosoxyhexacosane
CID 56611156

Frequently Asked Questions

What is the IUPAC name of octoxysilane;dihydrochloride?
The IUPAC name of octoxysilane;dihydrochloride (CID 174511468) is octoxysilane;dihydrochloride.
What is the SMILES notation for octoxysilane;dihydrochloride?
The canonical SMILES for octoxysilane;dihydrochloride is CCCCCCCCO[SiH3].Cl.Cl.
What is the InChIKey of octoxysilane;dihydrochloride?
The InChIKey is QLMNISJSWKVJST-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20OSi.2ClH/c1-2-3-4-5-6-7-8-9-10;;/h2-8H2,1,10H3;2*1H.
What are the key properties of octoxysilane;dihydrochloride?
octoxysilane;dihydrochloride has a molecular weight of 233.25 g/mol, XLogP of 2.49, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for octoxysilane;dihydrochloride is sourced from PubChem (CID 174511468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).