2-ethylhexoxy(phenoxy)phosphane

C14H23O2P — CID 23385803

IUPAC2-ethylhexoxy(phenoxy)phosphane
SMILESCCCCC(CC)COPOc1ccccc1
InChIInChI=1S/C14H23O2P/c1-3-5-9-13(4-2)12-15-17-16-14-10-7-6-8-11-14/h6-8,10-11,13,17H,3-5,9,12H2,1-2H3
InChIKeyNJERDFADXGQDTR-UHFFFAOYSA-N
MW254.31 g/mol
LogP4.81
Rot. Bonds9

About 2-ethylhexoxy(phenoxy)phosphane

2-ethylhexoxy(phenoxy)phosphane (PubChem CID 23385803) has the molecular formula C14H23O2P and a molecular weight of 254.31 g/mol. Its IUPAC name is 2-ethylhexoxy(phenoxy)phosphane.

Molecular Properties

Compound Name2-ethylhexoxy(phenoxy)phosphane
PubChem CID23385803
Molecular FormulaC14H23O2P
Molecular Weight254.31 g/mol
Exact Mass254.14
IUPAC Name2-ethylhexoxy(phenoxy)phosphane
SMILESCCCCC(CC)COPOc1ccccc1
InChIInChI=1S/C14H23O2P/c1-3-5-9-13(4-2)12-15-17-16-14-10-7-6-8-11-14/h6-8,10-11,13,17H,3-5,9,12H2,1-2H3
InChIKeyNJERDFADXGQDTR-UHFFFAOYSA-N
XLogP4.81
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.31
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

2-ethylhexoxybenzene;methoxyboronic acid
CID 23293414
1,4-bis[(2S)-2-ethylhexoxy]benzene
CID 67003802
CID 174494301
CID 174494301
2-ethylhexyl diphenyl phosphate;phosphoric acid
CID 172820434
diphenyl hydrogen phosphite;2-ethylhexyl dihydrogen phosphite
CID 161432608
4-ethyl-1-phenoxyoctan-2-amine
CID 63416527
1-[(2E,4E)-3,4-dimethyl-5-phenylhexa-2,4-dien-2-yl]-4-(2-ethylhexoxy)benzene
CID 59296842
[2-ethylhexoxy(hydroxy)phosphanyl] diphenyl phosphate
CID 174771557
ethanol;2-(2-ethylhexoxycarbonyl)benzoic acid
CID 175410629
sodium;hydride;phenyl 2-ethylhexane-1-sulfonate
CID 174718751
2-ethylhexyl-hydroxy-diphenoxyphosphanium;phosphorous acid
CID 137423428
2-ethylhexoxy(phenyl)phosphinic acid
CID 14299722

Frequently Asked Questions

What is the IUPAC name of 2-ethylhexoxy(phenoxy)phosphane?
The IUPAC name of 2-ethylhexoxy(phenoxy)phosphane (CID 23385803) is 2-ethylhexoxy(phenoxy)phosphane.
What is the SMILES notation for 2-ethylhexoxy(phenoxy)phosphane?
The canonical SMILES for 2-ethylhexoxy(phenoxy)phosphane is CCCCC(CC)COPOc1ccccc1.
What is the InChIKey of 2-ethylhexoxy(phenoxy)phosphane?
The InChIKey is NJERDFADXGQDTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23O2P/c1-3-5-9-13(4-2)12-15-17-16-14-10-7-6-8-11-14/h6-8,10-11,13,17H,3-5,9,12H2,1-2H3.
What are the key properties of 2-ethylhexoxy(phenoxy)phosphane?
2-ethylhexoxy(phenoxy)phosphane has a molecular weight of 254.31 g/mol, XLogP of 4.81, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylhexoxy(phenoxy)phosphane is sourced from PubChem (CID 23385803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).