hydroxy-oxo-pentanoylphosphanium

C5H10O3P+ — CID 175157620

IUPAChydroxy-oxo-pentanoylphosphanium
SMILESCCCCC(=O)[P+](=O)O
InChIInChI=1S/C5H9O3P/c1-2-3-4-5(6)9(7)8/h2-4H2,1H3/p+1
InChIKeyICXRXQYFCVSWNI-UHFFFAOYSA-O
MW149.11 g/mol
LogP1.44
Rot. Bonds4

About hydroxy-oxo-pentanoylphosphanium

hydroxy-oxo-pentanoylphosphanium (PubChem CID 175157620) has the molecular formula C5H10O3P+ and a molecular weight of 149.11 g/mol. Its IUPAC name is hydroxy-oxo-pentanoylphosphanium.

Molecular Properties

Compound Namehydroxy-oxo-pentanoylphosphanium
PubChem CID175157620
Molecular FormulaC5H10O3P+
Molecular Weight149.11 g/mol
Exact Mass149.04
IUPAC Namehydroxy-oxo-pentanoylphosphanium
SMILESCCCCC(=O)[P+](=O)O
InChIInChI=1S/C5H9O3P/c1-2-3-4-5(6)9(7)8/h2-4H2,1H3/p+1
InChIKeyICXRXQYFCVSWNI-UHFFFAOYSA-O
XLogP1.44
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.11
LogP ≤ 51.44
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

chromium;hydroxy-octadec-9-enoyl-oxophosphanium
CID 173015672
dihydroxy(oxo)phosphanium;dodecane
CID 18620358
dihydroxy(oxo)phosphanium;bis(octadecane)
CID 87485521
dihydroxy(oxo)phosphanium;octanoic acid
CID 158603772
hexane;phosphenous acid
CID 21406649
pentanoic acid;silver
CID 87285302
CID 159436476
CID 159436476
lanthanum;pentanoic acid
CID 88604988
ethane;pentanoic acid
CID 142198531
pentanoic acid;stannane
CID 173249748
Se-butyl pentaneselenoate
CID 10798996
gold(3+);tris(pentanoate)
CID 157094863

Frequently Asked Questions

What is the IUPAC name of hydroxy-oxo-pentanoylphosphanium?
The IUPAC name of hydroxy-oxo-pentanoylphosphanium (CID 175157620) is hydroxy-oxo-pentanoylphosphanium.
What is the SMILES notation for hydroxy-oxo-pentanoylphosphanium?
The canonical SMILES for hydroxy-oxo-pentanoylphosphanium is CCCCC(=O)[P+](=O)O.
What is the InChIKey of hydroxy-oxo-pentanoylphosphanium?
The InChIKey is ICXRXQYFCVSWNI-UHFFFAOYSA-O. The full InChI is InChI=1S/C5H9O3P/c1-2-3-4-5(6)9(7)8/h2-4H2,1H3/p+1.
What are the key properties of hydroxy-oxo-pentanoylphosphanium?
hydroxy-oxo-pentanoylphosphanium has a molecular weight of 149.11 g/mol, XLogP of 1.44, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-oxo-pentanoylphosphanium is sourced from PubChem (CID 175157620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).