CID 174748890

C10H22AlO2P — CID 174748890

IUPAC—
SMILESCCCCCC[Al+]CCCC.O=P[O-]
InChIInChI=1S/C6H13.C4H9.Al.HO2P/c1-3-5-6-4-2;1-3-4-2;;1-3-2/h1,3-6H2,2H3;1,3-4H2,2H3;;(H,1,2)/q;;+1;/p-1
InChIKeyYIWGZXCQIRHHPJ-UHFFFAOYSA-M
MW232.24 g/mol
LogP3.46
Rot. Bonds8

About CID 174748890

CID 174748890 (PubChem CID 174748890) has the molecular formula C10H22AlO2P and a molecular weight of 232.24 g/mol.

Molecular Properties

Compound NameCID 174748890
PubChem CID174748890
Molecular FormulaC10H22AlO2P
Molecular Weight232.24 g/mol
Exact Mass232.12
IUPAC Name—
SMILESCCCCCC[Al+]CCCC.O=P[O-]
InChIInChI=1S/C6H13.C4H9.Al.HO2P/c1-3-5-6-4-2;1-3-4-2;;1-3-2/h1,3-6H2,2H3;1,3-4H2,2H3;;(H,1,2)/q;;+1;/p-1
InChIKeyYIWGZXCQIRHHPJ-UHFFFAOYSA-M
XLogP3.46
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 53.46
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

diheptylalumanylium;sulfomethanolate
CID 174706446
dibutylalumanylium;trimethyl(oxido)silane
CID 87730250
dipropylalumanylium;hexane;hydride
CID 175456886
ethene;undecane
CID 161157037
triacontane
CID 12535
dictane
CID 19848341
dohexacontane
CID 522644
decane;heptane
CID 159049036
hexadecane;pentadecane
CID 159687875
dooctacontane
CID 522649
CID 161246447
CID 161246447
henoctacontane
CID 22086342

Frequently Asked Questions

What is the IUPAC name of CID 174748890?
The IUPAC name of CID 174748890 (CID 174748890) is not available.
What is the SMILES notation for CID 174748890?
The canonical SMILES for CID 174748890 is CCCCCC[Al+]CCCC.O=P[O-].
What is the InChIKey of CID 174748890?
The InChIKey is YIWGZXCQIRHHPJ-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H13.C4H9.Al.HO2P/c1-3-5-6-4-2;1-3-4-2;;1-3-2/h1,3-6H2,2H3;1,3-4H2,2H3;;(H,1,2)/q;;+1;/p-1.
What are the key properties of CID 174748890?
CID 174748890 has a molecular weight of 232.24 g/mol, XLogP of 3.46, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174748890 is sourced from PubChem (CID 174748890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).