heptane;methyl-nonyl-ditritiosilane

C17H40Si — CID 158446190

IUPACheptane;methyl-nonyl-ditritiosilane
SMILESCCCCCCC.[3H][Si]([3H])(C)CCCCCCCCC
InChIInChI=1S/C10H24Si.C7H16/c1-3-4-5-6-7-8-9-10-11-2;1-3-5-7-6-4-2/h3-11H2,1-2H3;3-7H2,1-2H3/i11T2;
InChIKeyHDKPWSNOJGDARA-HOHXVFBJSA-N
MW276.61 g/mol
LogP6.35
Rot. Bonds12

About heptane;methyl-nonyl-ditritiosilane

heptane;methyl-nonyl-ditritiosilane (PubChem CID 158446190) has the molecular formula C17H40Si and a molecular weight of 276.61 g/mol. Its IUPAC name is heptane;methyl-nonyl-ditritiosilane.

Molecular Properties

Compound Nameheptane;methyl-nonyl-ditritiosilane
PubChem CID158446190
Molecular FormulaC17H40Si
Molecular Weight276.61 g/mol
Exact Mass276.31
IUPAC Nameheptane;methyl-nonyl-ditritiosilane
SMILESCCCCCCC.[3H][Si]([3H])(C)CCCCCCCCC
InChIInChI=1S/C10H24Si.C7H16/c1-3-4-5-6-7-8-9-10-11-2;1-3-5-7-6-4-2/h3-11H2,1-2H3;3-7H2,1-2H3/i11T2;
InChIKeyHDKPWSNOJGDARA-HOHXVFBJSA-N
XLogP6.35
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500276.61
LogP ≤ 56.35
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

henicosyl(methyl)silane
CID 158685051
fluoro(hexadecyl)silane
CID 154076101
henoctacontane
CID 22086342
heptahectane
CID 123338944
dopentacontahectane
CID 23391374
hexacosane;octacosane
CID 158944700
bis(decane);hexane
CID 158666782
decane;heptane
CID 159049036
hexadecane;pentadecane
CID 159687875
dooctacontane
CID 522649
CID 161246447
CID 161246447
triacontane
CID 12535

Frequently Asked Questions

What is the IUPAC name of heptane;methyl-nonyl-ditritiosilane?
The IUPAC name of heptane;methyl-nonyl-ditritiosilane (CID 158446190) is heptane;methyl-nonyl-ditritiosilane.
What is the SMILES notation for heptane;methyl-nonyl-ditritiosilane?
The canonical SMILES for heptane;methyl-nonyl-ditritiosilane is CCCCCCC.[3H][Si]([3H])(C)CCCCCCCCC.
What is the InChIKey of heptane;methyl-nonyl-ditritiosilane?
The InChIKey is HDKPWSNOJGDARA-HOHXVFBJSA-N. The full InChI is InChI=1S/C10H24Si.C7H16/c1-3-4-5-6-7-8-9-10-11-2;1-3-5-7-6-4-2/h3-11H2,1-2H3;3-7H2,1-2H3/i11T2;.
What are the key properties of heptane;methyl-nonyl-ditritiosilane?
heptane;methyl-nonyl-ditritiosilane has a molecular weight of 276.61 g/mol, XLogP of 6.35, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for heptane;methyl-nonyl-ditritiosilane is sourced from PubChem (CID 158446190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).