dodecylphosphane;2-ethyldodecylphosphane

C26H58P2 — CID 122690433

IUPACdodecylphosphane;2-ethyldodecylphosphane
SMILESCCCCCCCCCCC(CC)CP.CCCCCCCCCCCCP
InChIInChI=1S/C14H31P.C12H27P/c1-3-5-6-7-8-9-10-11-12-14(4-2)13-15;1-2-3-4-5-6-7-8-9-10-11-12-13/h14H,3-13,15H2,1-2H3;2-13H2,1H3
InChIKeyNLAWGGTXNXZGIR-UHFFFAOYSA-N
MW432.70 g/mol
LogP10.20
Rot. Bonds21

About dodecylphosphane;2-ethyldodecylphosphane

dodecylphosphane;2-ethyldodecylphosphane (PubChem CID 122690433) has the molecular formula C26H58P2 and a molecular weight of 432.70 g/mol. Its IUPAC name is dodecylphosphane;2-ethyldodecylphosphane.

Molecular Properties

Compound Namedodecylphosphane;2-ethyldodecylphosphane
PubChem CID122690433
Molecular FormulaC26H58P2
Molecular Weight432.70 g/mol
Exact Mass432.40
IUPAC Namedodecylphosphane;2-ethyldodecylphosphane
SMILESCCCCCCCCCCC(CC)CP.CCCCCCCCCCCCP
InChIInChI=1S/C14H31P.C12H27P/c1-3-5-6-7-8-9-10-11-12-14(4-2)13-15;1-2-3-4-5-6-7-8-9-10-11-12-13/h14H,3-13,15H2,1-2H3;2-13H2,1H3
InChIKeyNLAWGGTXNXZGIR-UHFFFAOYSA-N
XLogP10.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds21
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.70
LogP ≤ 510.20
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

5-ethylheptylphosphane
CID 90926602
12-ethylhentriacontane
CID 91805956
15-ethyltetratriacontane
CID 23358557
3-ethylpentacosane
CID 22224239
3-ethylicosane
CID 528487
7-ethyltetracosane
CID 22223872
7-ethyltetradecane
CID 529902
ethane;3-ethylundecane
CID 144815521
7-ethyltridecane;methane
CID 158982306
4-ethylhexadecane
CID 528433
4-ethylnonadecane
CID 22223766
3-ethyloctane;propane
CID 143682929

Frequently Asked Questions

What is the IUPAC name of dodecylphosphane;2-ethyldodecylphosphane?
The IUPAC name of dodecylphosphane;2-ethyldodecylphosphane (CID 122690433) is dodecylphosphane;2-ethyldodecylphosphane.
What is the SMILES notation for dodecylphosphane;2-ethyldodecylphosphane?
The canonical SMILES for dodecylphosphane;2-ethyldodecylphosphane is CCCCCCCCCCC(CC)CP.CCCCCCCCCCCCP.
What is the InChIKey of dodecylphosphane;2-ethyldodecylphosphane?
The InChIKey is NLAWGGTXNXZGIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31P.C12H27P/c1-3-5-6-7-8-9-10-11-12-14(4-2)13-15;1-2-3-4-5-6-7-8-9-10-11-12-13/h14H,3-13,15H2,1-2H3;2-13H2,1H3.
What are the key properties of dodecylphosphane;2-ethyldodecylphosphane?
dodecylphosphane;2-ethyldodecylphosphane has a molecular weight of 432.70 g/mol, XLogP of 10.20, 21 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dodecylphosphane;2-ethyldodecylphosphane is sourced from PubChem (CID 122690433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).