azane;nonan-2-yl(dioctyl)phosphane

C25H56NP — CID 172807028

IUPACazane;nonan-2-yl(dioctyl)phosphane
SMILESCCCCCCCCP(CCCCCCCC)C(C)CCCCCCC.N
InChIInChI=1S/C25H53P.H3N/c1-5-8-11-14-17-20-23-26(24-21-18-15-12-9-6-2)25(4)22-19-16-13-10-7-3;/h25H,5-24H2,1-4H3;1H3
InChIKeyRQPPQFVLBRPPHM-UHFFFAOYSA-N
MW401.70 g/mol
LogP10.10
Rot. Bonds21

About azane;nonan-2-yl(dioctyl)phosphane

azane;nonan-2-yl(dioctyl)phosphane (PubChem CID 172807028) has the molecular formula C25H56NP and a molecular weight of 401.70 g/mol. Its IUPAC name is azane;nonan-2-yl(dioctyl)phosphane.

Molecular Properties

Compound Nameazane;nonan-2-yl(dioctyl)phosphane
PubChem CID172807028
Molecular FormulaC25H56NP
Molecular Weight401.70 g/mol
Exact Mass401.42
IUPAC Nameazane;nonan-2-yl(dioctyl)phosphane
SMILESCCCCCCCCP(CCCCCCCC)C(C)CCCCCCC.N
InChIInChI=1S/C25H53P.H3N/c1-5-8-11-14-17-20-23-26(24-21-18-15-12-9-6-2)25(4)22-19-16-13-10-7-3;/h25H,5-24H2,1-4H3;1H3
InChIKeyRQPPQFVLBRPPHM-UHFFFAOYSA-N
XLogP10.10
TPSA35.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds21
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500401.70
LogP ≤ 510.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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

azanium;nonan-2-yl(dioctyl)phosphane;nitrate
CID 172785276
diheptyl(propan-2-yl)phosphane
CID 22497662
1-dihexylphosphanylhexyl(dihexyl)phosphane
CID 90112069
1-dihexylphosphanyloctyl(dihexyl)phosphane
CID 90111410
dioctyl(tetracosan-8-yl)phosphane
CID 159416945
tris(decan-2-yl)phosphane
CID 90108783
dodecan-5-yl(dioctyl)phosphane
CID 172795592
decan-3-yl(dioctyl)phosphane
CID 150488617
dihexyl(nonan-4-yl)phosphane
CID 172773657
dibutyl(1-dibutylphosphanyloctyl)phosphane
CID 90109287
azane;2-methyloctadecane
CID 175414560
diheptyl(pentan-3-yl)phosphane
CID 87508325

Frequently Asked Questions

What is the IUPAC name of azane;nonan-2-yl(dioctyl)phosphane?
The IUPAC name of azane;nonan-2-yl(dioctyl)phosphane (CID 172807028) is azane;nonan-2-yl(dioctyl)phosphane.
What is the SMILES notation for azane;nonan-2-yl(dioctyl)phosphane?
The canonical SMILES for azane;nonan-2-yl(dioctyl)phosphane is CCCCCCCCP(CCCCCCCC)C(C)CCCCCCC.N.
What is the InChIKey of azane;nonan-2-yl(dioctyl)phosphane?
The InChIKey is RQPPQFVLBRPPHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H53P.H3N/c1-5-8-11-14-17-20-23-26(24-21-18-15-12-9-6-2)25(4)22-19-16-13-10-7-3;/h25H,5-24H2,1-4H3;1H3.
What are the key properties of azane;nonan-2-yl(dioctyl)phosphane?
azane;nonan-2-yl(dioctyl)phosphane has a molecular weight of 401.70 g/mol, XLogP of 10.10, 21 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azane;nonan-2-yl(dioctyl)phosphane is sourced from PubChem (CID 172807028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).