sodium;hydride;1-octylphosphinane

C13H28NaP — CID 173416325

IUPACsodium;hydride;1-octylphosphinane
SMILESCCCCCCCCP1CCCCC1.[H-].[Na+]
InChIInChI=1S/C13H27P.Na.H/c1-2-3-4-5-6-8-11-14-12-9-7-10-13-14;;/h2-13H2,1H3;;/q;+1;-1
InChIKeyNCSWVXPBGCWJBB-UHFFFAOYSA-N
MW238.33 g/mol
LogP2.13
Rot. Bonds7

About sodium;hydride;1-octylphosphinane

sodium;hydride;1-octylphosphinane (PubChem CID 173416325) has the molecular formula C13H28NaP and a molecular weight of 238.33 g/mol. Its IUPAC name is sodium;hydride;1-octylphosphinane.

Molecular Properties

Compound Namesodium;hydride;1-octylphosphinane
PubChem CID173416325
Molecular FormulaC13H28NaP
Molecular Weight238.33 g/mol
Exact Mass238.18
IUPAC Namesodium;hydride;1-octylphosphinane
SMILESCCCCCCCCP1CCCCC1.[H-].[Na+]
InChIInChI=1S/C13H27P.Na.H/c1-2-3-4-5-6-8-11-14-12-9-7-10-13-14;;/h2-13H2,1H3;;/q;+1;-1
InChIKeyNCSWVXPBGCWJBB-UHFFFAOYSA-N
XLogP2.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-octylphospholane
CID 66657464
cyclopropane;octadecane
CID 174865519
cyclopropane;icosane
CID 162221728
sodium;hydride;tridecane
CID 172995973
sodium;octakis(decane);hydride
CID 173398930
cyclopentane;ethane;pentane
CID 143543629
cyclobutane;ethane;hexane
CID 143857678
magnesium;sodium;hydride;tetradecane
CID 173272965
cobalt;cyclooctane;pentane
CID 57373062
disodium;dodecane;hydride;hydrochloride
CID 175364607
alumane;cyclohexane;hexane
CID 175455201
tetrakis(nonane);bis(pentane)
CID 158390230

Frequently Asked Questions

What is the IUPAC name of sodium;hydride;1-octylphosphinane?
The IUPAC name of sodium;hydride;1-octylphosphinane (CID 173416325) is sodium;hydride;1-octylphosphinane.
What is the SMILES notation for sodium;hydride;1-octylphosphinane?
The canonical SMILES for sodium;hydride;1-octylphosphinane is CCCCCCCCP1CCCCC1.[H-].[Na+].
What is the InChIKey of sodium;hydride;1-octylphosphinane?
The InChIKey is NCSWVXPBGCWJBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27P.Na.H/c1-2-3-4-5-6-8-11-14-12-9-7-10-13-14;;/h2-13H2,1H3;;/q;+1;-1.
What are the key properties of sodium;hydride;1-octylphosphinane?
sodium;hydride;1-octylphosphinane has a molecular weight of 238.33 g/mol, XLogP of 2.13, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;hydride;1-octylphosphinane is sourced from PubChem (CID 173416325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).