hexakis(decane);manganese

C60H132Mn — CID 173234782

IUPAChexakis(decane);manganese
SMILESCCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC.[Mn]
InChIInChI=1S/6C10H22.Mn/c6*1-3-5-7-9-10-8-6-4-2;/h6*3-10H2,1-2H3;
InChIKeyWNQFAIDJJVTRBO-UHFFFAOYSA-N
MW908.65 g/mol
LogP24.88
Rot. Bonds42

About hexakis(decane);manganese

hexakis(decane);manganese (PubChem CID 173234782) has the molecular formula C60H132Mn and a molecular weight of 908.65 g/mol. Its IUPAC name is hexakis(decane);manganese.

Molecular Properties

Compound Namehexakis(decane);manganese
PubChem CID173234782
Molecular FormulaC60H132Mn
Molecular Weight908.65 g/mol
Exact Mass907.97
IUPAC Namehexakis(decane);manganese
SMILESCCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC.[Mn]
InChIInChI=1S/6C10H22.Mn/c6*1-3-5-7-9-10-8-6-4-2;/h6*3-10H2,1-2H3;
InChIKeyWNQFAIDJJVTRBO-UHFFFAOYSA-N
XLogP24.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds42
Heavy Atoms61
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500908.65
LogP ≤ 524.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

manganese;tetracosane
CID 175605770
dohexacontane
CID 522644
hexadecane;pentadecane
CID 159687875
dooctacontane
CID 522649
hexacosane;octacosane
CID 158944700
bis(decane);hexane
CID 158666782
decane;heptane
CID 159049036
henoctacontane
CID 22086342
CID 161246447
CID 161246447
triacontane
CID 12535
dictane
CID 19848341
heptahectane
CID 123338944

Frequently Asked Questions

What is the IUPAC name of hexakis(decane);manganese?
The IUPAC name of hexakis(decane);manganese (CID 173234782) is hexakis(decane);manganese.
What is the SMILES notation for hexakis(decane);manganese?
The canonical SMILES for hexakis(decane);manganese is CCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC.CCCCCCCCCC.[Mn].
What is the InChIKey of hexakis(decane);manganese?
The InChIKey is WNQFAIDJJVTRBO-UHFFFAOYSA-N. The full InChI is InChI=1S/6C10H22.Mn/c6*1-3-5-7-9-10-8-6-4-2;/h6*3-10H2,1-2H3;.
What are the key properties of hexakis(decane);manganese?
hexakis(decane);manganese has a molecular weight of 908.65 g/mol, XLogP of 24.88, 42 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hexakis(decane);manganese is sourced from PubChem (CID 173234782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).