dilithium;ethanolate;propan-2-olate

C5H12Li2O2 — CID 175696878

IUPACdilithium;ethanolate;propan-2-olate
SMILESCC(C)[O-].CC[O-].[Li+].[Li+]
InChIInChI=1S/C3H7O.C2H5O.2Li/c1-3(2)4;1-2-3;;/h3H,1-2H3;2H2,1H3;;/q2*-1;2*+1
InChIKeyQMBCJTZIVKNZNG-UHFFFAOYSA-N
MW118.03 g/mol
LogP-6.87
Rot. Bonds

About dilithium;ethanolate;propan-2-olate

dilithium;ethanolate;propan-2-olate (PubChem CID 175696878) has the molecular formula C5H12Li2O2 and a molecular weight of 118.03 g/mol. Its IUPAC name is dilithium;ethanolate;propan-2-olate.

Molecular Properties

Compound Namedilithium;ethanolate;propan-2-olate
PubChem CID175696878
Molecular FormulaC5H12Li2O2
Molecular Weight118.03 g/mol
Exact Mass118.12
IUPAC Namedilithium;ethanolate;propan-2-olate
SMILESCC(C)[O-].CC[O-].[Li+].[Li+]
InChIInChI=1S/C3H7O.C2H5O.2Li/c1-3(2)4;1-2-3;;/h3H,1-2H3;2H2,1H3;;/q2*-1;2*+1
InChIKeyQMBCJTZIVKNZNG-UHFFFAOYSA-N
XLogP-6.87
TPSA46.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.03
LogP ≤ 5-6.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Peroxide, bis(1-methylethyl)
CID 140114
Strontium isopropoxide
CID 6099237
Barium isopropoxide
CID 6101105
Magnesium dipropan-2-olate
CID 10197750
Calcium propan-2-olate
CID 13766994
2-propanol, zinc salt
CID 14009701
Copper (II) isopropoxide
CID 14389592
Cobalt(II) isopropoxide
CID 18517386
Barium i-propoxide, dry powder
CID 4456486
2-Propanol, strontiumsalt (9CI)
CID 4691581
Calcium isopropoxide
CID 11389540
2-({[(Propan-2-yl)oxy]sulfanyl}oxy)propane
CID 12497509

Frequently Asked Questions

What is the IUPAC name of dilithium;ethanolate;propan-2-olate?
The IUPAC name of dilithium;ethanolate;propan-2-olate (CID 175696878) is dilithium;ethanolate;propan-2-olate.
What is the SMILES notation for dilithium;ethanolate;propan-2-olate?
The canonical SMILES for dilithium;ethanolate;propan-2-olate is CC(C)[O-].CC[O-].[Li+].[Li+].
What is the InChIKey of dilithium;ethanolate;propan-2-olate?
The InChIKey is QMBCJTZIVKNZNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7O.C2H5O.2Li/c1-3(2)4;1-2-3;;/h3H,1-2H3;2H2,1H3;;/q2*-1;2*+1.
What are the key properties of dilithium;ethanolate;propan-2-olate?
dilithium;ethanolate;propan-2-olate has a molecular weight of 118.03 g/mol, XLogP of -6.87, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dilithium;ethanolate;propan-2-olate is sourced from PubChem (CID 175696878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).