2-ethylhexoxy(phenyl)phosphinic acid

C14H23O3P — CID 14299722

IUPAC2-ethylhexoxy(phenyl)phosphinic acid
SMILESCCCCC(CC)COP(=O)(O)c1ccccc1
InChIInChI=1S/C14H23O3P/c1-3-5-9-13(4-2)12-17-18(15,16)14-10-7-6-8-11-14/h6-8,10-11,13H,3-5,9,12H2,1-2H3,(H,15,16)
InChIKeyZEEAKSCKDKDZEF-UHFFFAOYSA-N
MW270.31 g/mol
LogP3.73
Rot. Bonds8

About 2-ethylhexoxy(phenyl)phosphinic acid

2-ethylhexoxy(phenyl)phosphinic acid (PubChem CID 14299722) has the molecular formula C14H23O3P and a molecular weight of 270.31 g/mol. Its IUPAC name is 2-ethylhexoxy(phenyl)phosphinic acid.

Molecular Properties

Compound Name2-ethylhexoxy(phenyl)phosphinic acid
PubChem CID14299722
Molecular FormulaC14H23O3P
Molecular Weight270.31 g/mol
Exact Mass270.14
IUPAC Name2-ethylhexoxy(phenyl)phosphinic acid
SMILESCCCCC(CC)COP(=O)(O)c1ccccc1
InChIInChI=1S/C14H23O3P/c1-3-5-9-13(4-2)12-17-18(15,16)14-10-7-6-8-11-14/h6-8,10-11,13H,3-5,9,12H2,1-2H3,(H,15,16)
InChIKeyZEEAKSCKDKDZEF-UHFFFAOYSA-N
XLogP3.73
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.31
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-hexyldodecoxy(phenyl)phosphinic acid
CID 10223298
2-ethylhexyl diphenyl phosphate;phosphoric acid
CID 172820434
[2-ethylhexoxy(tetradecyl)phosphoryl]benzene
CID 70125181
CID 87184341
CID 87184341
CID 131883274
CID 131883274
azane;bis(2-ethylhexyl) hydrogen phosphate;carbonic acid
CID 174232121
sodium;2-ethylhexyl dihydrogen phosphate;hydride
CID 173063880
2-ethylhexyl diphenyl phosphate;2-methylprop-2-enoic acid
CID 67913752
potassium 2-ethylhexyl hydrogen phosphate
CID 23690393
butyl(2-ethylhexoxy)phosphinic acid
CID 57079247
N-[bis(2-ethylhexoxy)phosphorylmethyl]-1-phenylmethanamine
CID 15389105
[2-ethylhexoxy(hydroxy)phosphoryl] phosphono hydrogen phosphate
CID 57171045

Frequently Asked Questions

What is the IUPAC name of 2-ethylhexoxy(phenyl)phosphinic acid?
The IUPAC name of 2-ethylhexoxy(phenyl)phosphinic acid (CID 14299722) is 2-ethylhexoxy(phenyl)phosphinic acid.
What is the SMILES notation for 2-ethylhexoxy(phenyl)phosphinic acid?
The canonical SMILES for 2-ethylhexoxy(phenyl)phosphinic acid is CCCCC(CC)COP(=O)(O)c1ccccc1.
What is the InChIKey of 2-ethylhexoxy(phenyl)phosphinic acid?
The InChIKey is ZEEAKSCKDKDZEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23O3P/c1-3-5-9-13(4-2)12-17-18(15,16)14-10-7-6-8-11-14/h6-8,10-11,13H,3-5,9,12H2,1-2H3,(H,15,16).
What are the key properties of 2-ethylhexoxy(phenyl)phosphinic acid?
2-ethylhexoxy(phenyl)phosphinic acid has a molecular weight of 270.31 g/mol, XLogP of 3.73, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylhexoxy(phenyl)phosphinic acid is sourced from PubChem (CID 14299722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).