alumane;carboxy(trihydroxy)phosphanium

CH7AlO5P+ — CID 174760708

IUPACalumane;carboxy(trihydroxy)phosphanium
SMILESO=C(O)[P+](O)(O)O.[AlH3]
InChIInChI=1S/CH3O5P.Al.3H/c2-1(3)7(4,5)6;;;;/h4-6H;;;;/p+1
InChIKeyJVDSJYZLTSVGMP-UHFFFAOYSA-O
MW157.02 g/mol
LogP-1.78
Rot. Bonds1

About alumane;carboxy(trihydroxy)phosphanium

alumane;carboxy(trihydroxy)phosphanium (PubChem CID 174760708) has the molecular formula CH7AlO5P+ and a molecular weight of 157.02 g/mol. Its IUPAC name is alumane;carboxy(trihydroxy)phosphanium.

Molecular Properties

Compound Namealumane;carboxy(trihydroxy)phosphanium
PubChem CID174760708
Molecular FormulaCH7AlO5P+
Molecular Weight157.02 g/mol
Exact Mass156.98
IUPAC Namealumane;carboxy(trihydroxy)phosphanium
SMILESO=C(O)[P+](O)(O)O.[AlH3]
InChIInChI=1S/CH3O5P.Al.3H/c2-1(3)7(4,5)6;;;;/h4-6H;;;;/p+1
InChIKeyJVDSJYZLTSVGMP-UHFFFAOYSA-O
XLogP-1.78
TPSA97.99 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.02
LogP ≤ 5-1.78
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of alumane;carboxy(trihydroxy)phosphanium?
The IUPAC name of alumane;carboxy(trihydroxy)phosphanium (CID 174760708) is alumane;carboxy(trihydroxy)phosphanium.
What is the SMILES notation for alumane;carboxy(trihydroxy)phosphanium?
The canonical SMILES for alumane;carboxy(trihydroxy)phosphanium is O=C(O)[P+](O)(O)O.[AlH3].
What is the InChIKey of alumane;carboxy(trihydroxy)phosphanium?
The InChIKey is JVDSJYZLTSVGMP-UHFFFAOYSA-O. The full InChI is InChI=1S/CH3O5P.Al.3H/c2-1(3)7(4,5)6;;;;/h4-6H;;;;/p+1.
What are the key properties of alumane;carboxy(trihydroxy)phosphanium?
alumane;carboxy(trihydroxy)phosphanium has a molecular weight of 157.02 g/mol, XLogP of -1.78, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for alumane;carboxy(trihydroxy)phosphanium is sourced from PubChem (CID 174760708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).