sodium;chloro(trimethyl)silane;octanenitrile;iodide

C11H24ClINNaSi — CID 173247567

IUPACsodium;chloro(trimethyl)silane;octanenitrile;iodide
SMILESCCCCCCCC#N.C[Si](C)(C)Cl.[I-].[Na+]
InChIInChI=1S/C8H15N.C3H9ClSi.HI.Na/c1-2-3-4-5-6-7-8-9;1-5(2,3)4;;/h2-7H2,1H3;1-3H3;1H;/q;;;+1/p-1
InChIKeyWQSIJDOTJBIPFN-UHFFFAOYSA-M
MW383.75 g/mol
LogP-1.06
Rot. Bonds5

About sodium;chloro(trimethyl)silane;octanenitrile;iodide

sodium;chloro(trimethyl)silane;octanenitrile;iodide (PubChem CID 173247567) has the molecular formula C11H24ClINNaSi and a molecular weight of 383.75 g/mol. Its IUPAC name is sodium;chloro(trimethyl)silane;octanenitrile;iodide.

Molecular Properties

Compound Namesodium;chloro(trimethyl)silane;octanenitrile;iodide
PubChem CID173247567
Molecular FormulaC11H24ClINNaSi
Molecular Weight383.75 g/mol
Exact Mass383.03
IUPAC Namesodium;chloro(trimethyl)silane;octanenitrile;iodide
SMILESCCCCCCCC#N.C[Si](C)(C)Cl.[I-].[Na+]
InChIInChI=1S/C8H15N.C3H9ClSi.HI.Na/c1-2-3-4-5-6-7-8-9;1-5(2,3)4;;/h2-7H2,1H3;1-3H3;1H;/q;;;+1/p-1
InChIKeyWQSIJDOTJBIPFN-UHFFFAOYSA-M
XLogP-1.06
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.75
LogP ≤ 5-1.06
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'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Related Compounds

octadecanenitrile
CID 12532
undecanenitrile
CID 16722
henicos-10-ynenitrile;hydrochloride
CID 142049012
6-hexyltridecanenitrile
CID 129015600
octadec-6-enenitrile
CID 54098739
4-[butyl(dichloro)silyl]butanenitrile
CID 11806313
16-(dihexadecylamino)hexadecanenitrile
CID 139661963
21-methylhentriacontanenitrile
CID 527382
5-[chloro(dimethyl)silyl]pentanenitrile
CID 87524808
21,25-dimethylhentriacontanenitrile
CID 527376
henicosanedinitrile
CID 87345062
1-isocyanooctane;8-isocyanooctanenitrile
CID 161128912

Frequently Asked Questions

What is the IUPAC name of sodium;chloro(trimethyl)silane;octanenitrile;iodide?
The IUPAC name of sodium;chloro(trimethyl)silane;octanenitrile;iodide (CID 173247567) is sodium;chloro(trimethyl)silane;octanenitrile;iodide.
What is the SMILES notation for sodium;chloro(trimethyl)silane;octanenitrile;iodide?
The canonical SMILES for sodium;chloro(trimethyl)silane;octanenitrile;iodide is CCCCCCCC#N.C[Si](C)(C)Cl.[I-].[Na+].
What is the InChIKey of sodium;chloro(trimethyl)silane;octanenitrile;iodide?
The InChIKey is WQSIJDOTJBIPFN-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H15N.C3H9ClSi.HI.Na/c1-2-3-4-5-6-7-8-9;1-5(2,3)4;;/h2-7H2,1H3;1-3H3;1H;/q;;;+1/p-1.
What are the key properties of sodium;chloro(trimethyl)silane;octanenitrile;iodide?
sodium;chloro(trimethyl)silane;octanenitrile;iodide has a molecular weight of 383.75 g/mol, XLogP of -1.06, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;chloro(trimethyl)silane;octanenitrile;iodide is sourced from PubChem (CID 173247567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).