alumane;ethyl dihydrogen phosphate

C2H10AlO4P — CID 173113989

IUPACalumane;ethyl dihydrogen phosphate
SMILESCCOP(=O)(O)O.[AlH3]
InChIInChI=1S/C2H7O4P.Al.3H/c1-2-6-7(3,4)5;;;;/h2H2,1H3,(H2,3,4,5);;;;
InChIKeyNMVJYLZKXNYRRL-UHFFFAOYSA-N
MW156.05 g/mol
LogP-1.07
Rot. Bonds2

About alumane;ethyl dihydrogen phosphate

alumane;ethyl dihydrogen phosphate (PubChem CID 173113989) has the molecular formula C2H10AlO4P and a molecular weight of 156.05 g/mol. Its IUPAC name is alumane;ethyl dihydrogen phosphate.

Molecular Properties

Compound Namealumane;ethyl dihydrogen phosphate
PubChem CID173113989
Molecular FormulaC2H10AlO4P
Molecular Weight156.05 g/mol
Exact Mass156.01
IUPAC Namealumane;ethyl dihydrogen phosphate
SMILESCCOP(=O)(O)O.[AlH3]
InChIInChI=1S/C2H7O4P.Al.3H/c1-2-6-7(3,4)5;;;;/h2H2,1H3,(H2,3,4,5);;;;
InChIKeyNMVJYLZKXNYRRL-UHFFFAOYSA-N
XLogP-1.07
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.05
LogP ≤ 5-1.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

alumane;tris(ethyl dihydrogen phosphate)
CID 173189565
azane;bis(ethyl dihydrogen phosphate)
CID 174611775
CID 87495286
CID 87495286
potassium;tris(ethyl dihydrogen phosphate);hydride
CID 173395794
ethyl dihydrogen phosphate;N-methylmethanamine
CID 88518083
ethyl dihydrogen phosphate;trimethyl phosphate
CID 160912301
sodium;dihydroxy(oxo)phosphanium;ethyl dihydrogen phosphate;hydride
CID 173290588
CID 54611578
CID 54611578
diethyl hydrogen phosphate;phosphoric acid
CID 87753541
copper;diethyl hydrogen phosphate
CID 174593393
diethyl hydrogen phosphate;sulfane
CID 88774651
diethyl hydrogen phosphate;scandium
CID 54607585

Frequently Asked Questions

What is the IUPAC name of alumane;ethyl dihydrogen phosphate?
The IUPAC name of alumane;ethyl dihydrogen phosphate (CID 173113989) is alumane;ethyl dihydrogen phosphate.
What is the SMILES notation for alumane;ethyl dihydrogen phosphate?
The canonical SMILES for alumane;ethyl dihydrogen phosphate is CCOP(=O)(O)O.[AlH3].
What is the InChIKey of alumane;ethyl dihydrogen phosphate?
The InChIKey is NMVJYLZKXNYRRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7O4P.Al.3H/c1-2-6-7(3,4)5;;;;/h2H2,1H3,(H2,3,4,5);;;;.
What are the key properties of alumane;ethyl dihydrogen phosphate?
alumane;ethyl dihydrogen phosphate has a molecular weight of 156.05 g/mol, XLogP of -1.07, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for alumane;ethyl dihydrogen phosphate is sourced from PubChem (CID 173113989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).