bis(decane);phenoxyphosphane

C26H51OP — CID 91140487

IUPACbis(decane);phenoxyphosphane
SMILESCCCCCCCCCC.CCCCCCCCCC.POc1ccccc1
InChIInChI=1S/2C10H22.C6H7OP/c2*1-3-5-7-9-10-8-6-4-2;8-7-6-4-2-1-3-5-6/h2*3-10H2,1-2H3;1-5H,8H2
InChIKeyRBWDHWGBLUZHGV-UHFFFAOYSA-N
MW410.67 g/mol
LogP10.15
Rot. Bonds15

About bis(decane);phenoxyphosphane

bis(decane);phenoxyphosphane (PubChem CID 91140487) has the molecular formula C26H51OP and a molecular weight of 410.67 g/mol. Its IUPAC name is bis(decane);phenoxyphosphane.

Molecular Properties

Compound Namebis(decane);phenoxyphosphane
PubChem CID91140487
Molecular FormulaC26H51OP
Molecular Weight410.67 g/mol
Exact Mass410.37
IUPAC Namebis(decane);phenoxyphosphane
SMILESCCCCCCCCCC.CCCCCCCCCC.POc1ccccc1
InChIInChI=1S/2C10H22.C6H7OP/c2*1-3-5-7-9-10-8-6-4-2;8-7-6-4-2-1-3-5-6/h2*3-10H2,1-2H3;1-5H,8H2
InChIKeyRBWDHWGBLUZHGV-UHFFFAOYSA-N
XLogP10.15
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds15
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.67
LogP ≤ 510.15
H-Bond Donors ≤ 50
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

pentoxybenzene;undecane
CID 174778179
nickel;phenoxyphosphane
CID 158547426
ethene;nonoxybenzene;sulfane
CID 174919596
phenoxymethylbenzene;tetradecane
CID 175006528
dodecoxybenzene;ethene;hydrate
CID 174804981
1,1'-biphenyl;hexadecane
CID 173308514
1-methoxydecoxybenzene
CID 24977925
dioctyl(phenoxy)alumane
CID 86089915
1,1-diphenoxydecoxybenzene
CID 150135541
hexatriacontoxymethoxybenzene
CID 21131247
nonoxymethoxybenzene
CID 151123684
tetracosan-8-yloxybenzene
CID 154135377

Frequently Asked Questions

What is the IUPAC name of bis(decane);phenoxyphosphane?
The IUPAC name of bis(decane);phenoxyphosphane (CID 91140487) is bis(decane);phenoxyphosphane.
What is the SMILES notation for bis(decane);phenoxyphosphane?
The canonical SMILES for bis(decane);phenoxyphosphane is CCCCCCCCCC.CCCCCCCCCC.POc1ccccc1.
What is the InChIKey of bis(decane);phenoxyphosphane?
The InChIKey is RBWDHWGBLUZHGV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H22.C6H7OP/c2*1-3-5-7-9-10-8-6-4-2;8-7-6-4-2-1-3-5-6/h2*3-10H2,1-2H3;1-5H,8H2.
What are the key properties of bis(decane);phenoxyphosphane?
bis(decane);phenoxyphosphane has a molecular weight of 410.67 g/mol, XLogP of 10.15, 15 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bis(decane);phenoxyphosphane is sourced from PubChem (CID 91140487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).