bis(2-ethylhexanoic acid);manganese(3+)

C16H32MnO4+3 — CID 175736722

IUPACbis(2-ethylhexanoic acid);manganese(3+)
SMILESCCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.[Mn+3]
InChIInChI=1S/2C8H16O2.Mn/c2*1-3-5-6-7(4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+3
InChIKeyPVDVQEXLCSCHGM-UHFFFAOYSA-N
MW343.37 g/mol
LogP4.57
Rot. Bonds10

About bis(2-ethylhexanoic acid);manganese(3+)

bis(2-ethylhexanoic acid);manganese(3+) (PubChem CID 175736722) has the molecular formula C16H32MnO4+3 and a molecular weight of 343.37 g/mol. Its IUPAC name is bis(2-ethylhexanoic acid);manganese(3+).

Molecular Properties

Compound Namebis(2-ethylhexanoic acid);manganese(3+)
PubChem CID175736722
Molecular FormulaC16H32MnO4+3
Molecular Weight343.37 g/mol
Exact Mass343.17
IUPAC Namebis(2-ethylhexanoic acid);manganese(3+)
SMILESCCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.[Mn+3]
InChIInChI=1S/2C8H16O2.Mn/c2*1-3-5-6-7(4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+3
InChIKeyPVDVQEXLCSCHGM-UHFFFAOYSA-N
XLogP4.57
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.37
LogP ≤ 54.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethylhexanoic acid;palladium(2+)
CID 18629949
cobalt;bis(2-ethylhexanoic acid)
CID 85390748
2-ethylhexanoic acid;niobium
CID 87060397
tetrakis(2-ethylhexanoic acid);hafnium
CID 140535448
copper 2-ethylhexanoic acid
CID 54604905
bis(2-ethylhexanoic acid);manganese
CID 173402583
barium(2+);2-ethylhexanoic acid;hydride
CID 172997422
2-ethylhexanoic acid;hexadecane
CID 174408772
cobalt;bis(2-ethylhexanoic acid);nickel
CID 173442875
tris(2-ethylhexanoic acid);propan-2-yl-λ2-stannane
CID 173133127
cyclohexane;2-ethylhexanoic acid;nickel
CID 174366727
boric acid;2-ethylhexanoic acid;niobium
CID 163361263

Frequently Asked Questions

What is the IUPAC name of bis(2-ethylhexanoic acid);manganese(3+)?
The IUPAC name of bis(2-ethylhexanoic acid);manganese(3+) (CID 175736722) is bis(2-ethylhexanoic acid);manganese(3+).
What is the SMILES notation for bis(2-ethylhexanoic acid);manganese(3+)?
The canonical SMILES for bis(2-ethylhexanoic acid);manganese(3+) is CCCCC(CC)C(=O)O.CCCCC(CC)C(=O)O.[Mn+3].
What is the InChIKey of bis(2-ethylhexanoic acid);manganese(3+)?
The InChIKey is PVDVQEXLCSCHGM-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H16O2.Mn/c2*1-3-5-6-7(4-2)8(9)10;/h2*7H,3-6H2,1-2H3,(H,9,10);/q;;+3.
What are the key properties of bis(2-ethylhexanoic acid);manganese(3+)?
bis(2-ethylhexanoic acid);manganese(3+) has a molecular weight of 343.37 g/mol, XLogP of 4.57, 10 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-ethylhexanoic acid);manganese(3+) is sourced from PubChem (CID 175736722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).