bis(octane);silane;dihydrochloride

C16H42Cl2Si — CID 173470119

IUPACbis(octane);silane;dihydrochloride
SMILESCCCCCCCC.CCCCCCCC.Cl.Cl.[SiH4]
InChIInChI=1S/2C8H18.2ClH.H4Si/c2*1-3-5-7-8-6-4-2;;;/h2*3-8H2,1-2H3;2*1H;1H4
InChIKeyODLFNWLZZACGOG-UHFFFAOYSA-N
MW333.50 g/mol
LogP6.13
Rot. Bonds10

About bis(octane);silane;dihydrochloride

bis(octane);silane;dihydrochloride (PubChem CID 173470119) has the molecular formula C16H42Cl2Si and a molecular weight of 333.50 g/mol. Its IUPAC name is bis(octane);silane;dihydrochloride.

Molecular Properties

Compound Namebis(octane);silane;dihydrochloride
PubChem CID173470119
Molecular FormulaC16H42Cl2Si
Molecular Weight333.50 g/mol
Exact Mass332.24
IUPAC Namebis(octane);silane;dihydrochloride
SMILESCCCCCCCC.CCCCCCCC.Cl.Cl.[SiH4]
InChIInChI=1S/2C8H18.2ClH.H4Si/c2*1-3-5-7-8-6-4-2;;;/h2*3-8H2,1-2H3;2*1H;1H4
InChIKeyODLFNWLZZACGOG-UHFFFAOYSA-N
XLogP6.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500333.50
LogP ≤ 56.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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

heptane;silane;trihydrochloride
CID 173470147
icosane;tetrahydrochloride
CID 143212018
bis(heptane);hydrochloride
CID 160833718
pentacosane;hydrochloride
CID 172714496
nonadecane;hydrochloride
CID 172821128
methane;octane;dihydrochloride
CID 174397937
heptane;phosphane;trihydrochloride
CID 175501735
azane;tritriacontane;hydrochloride
CID 174841743
dodecane;phosphane;dihydrochloride
CID 173449681
dohexacontane
CID 522644
hexacosane;octacosane
CID 158944700
bis(decane);hexane
CID 158666782

Frequently Asked Questions

What is the IUPAC name of bis(octane);silane;dihydrochloride?
The IUPAC name of bis(octane);silane;dihydrochloride (CID 173470119) is bis(octane);silane;dihydrochloride.
What is the SMILES notation for bis(octane);silane;dihydrochloride?
The canonical SMILES for bis(octane);silane;dihydrochloride is CCCCCCCC.CCCCCCCC.Cl.Cl.[SiH4].
What is the InChIKey of bis(octane);silane;dihydrochloride?
The InChIKey is ODLFNWLZZACGOG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H18.2ClH.H4Si/c2*1-3-5-7-8-6-4-2;;;/h2*3-8H2,1-2H3;2*1H;1H4.
What are the key properties of bis(octane);silane;dihydrochloride?
bis(octane);silane;dihydrochloride has a molecular weight of 333.50 g/mol, XLogP of 6.13, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(octane);silane;dihydrochloride is sourced from PubChem (CID 173470119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).