CID 134978942

C6H14AlLiO2 — CID 134978942

IUPAC—
SMILESCC(C)O[Al-]OC(C)C.[Li+]
InChIInChI=1S/2C3H7O.Al.Li/c2*1-3(2)4;;/h2*3H,1-2H3;;/q2*-1;2*+1
InChIKeyRMXMXMICZCDSJH-UHFFFAOYSA-N
MW152.10 g/mol
LogP-1.63
Rot. Bonds4

About CID 134978942

CID 134978942 (PubChem CID 134978942) has the molecular formula C6H14AlLiO2 and a molecular weight of 152.10 g/mol.

Molecular Properties

Compound NameCID 134978942
PubChem CID134978942
Molecular FormulaC6H14AlLiO2
Molecular Weight152.10 g/mol
Exact Mass152.10
IUPAC Name—
SMILESCC(C)O[Al-]OC(C)C.[Li+]
InChIInChI=1S/2C3H7O.Al.Li/c2*1-3(2)4;;/h2*3H,1-2H3;;/q2*-1;2*+1
InChIKeyRMXMXMICZCDSJH-UHFFFAOYSA-N
XLogP-1.63
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.10
LogP ≤ 5-1.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of CID 134978942?
The IUPAC name of CID 134978942 (CID 134978942) is not available.
What is the SMILES notation for CID 134978942?
The canonical SMILES for CID 134978942 is CC(C)O[Al-]OC(C)C.[Li+].
What is the InChIKey of CID 134978942?
The InChIKey is RMXMXMICZCDSJH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H7O.Al.Li/c2*1-3(2)4;;/h2*3H,1-2H3;;/q2*-1;2*+1.
What are the key properties of CID 134978942?
CID 134978942 has a molecular weight of 152.10 g/mol, XLogP of -1.63, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 134978942 is sourced from PubChem (CID 134978942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).