hexane;molybdenum

C6H14Mo — CID 162092649

IUPAChexane;molybdenum
SMILESCCCCCC.[Mo]
InChIInChI=1S/C6H14.Mo/c1-3-5-6-4-2;/h3-6H2,1-2H3;
InChIKeyZDVAVEKUKQEXEX-UHFFFAOYSA-N
MW182.12 g/mol
LogP2.58
Rot. Bonds3

About hexane;molybdenum

hexane;molybdenum (PubChem CID 162092649) has the molecular formula C6H14Mo and a molecular weight of 182.12 g/mol. Its IUPAC name is hexane;molybdenum.

Molecular Properties

Compound Namehexane;molybdenum
PubChem CID162092649
Molecular FormulaC6H14Mo
Molecular Weight182.12 g/mol
Exact Mass184.01
IUPAC Namehexane;molybdenum
SMILESCCCCCC.[Mo]
InChIInChI=1S/C6H14.Mo/c1-3-5-6-4-2;/h3-6H2,1-2H3;
InChIKeyZDVAVEKUKQEXEX-UHFFFAOYSA-N
XLogP2.58
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.12
LogP ≤ 52.58
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

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hexane;tetrahydrochloride
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CID 161246447

Frequently Asked Questions

What is the IUPAC name of hexane;molybdenum?
The IUPAC name of hexane;molybdenum (CID 162092649) is hexane;molybdenum.
What is the SMILES notation for hexane;molybdenum?
The canonical SMILES for hexane;molybdenum is CCCCCC.[Mo].
What is the InChIKey of hexane;molybdenum?
The InChIKey is ZDVAVEKUKQEXEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14.Mo/c1-3-5-6-4-2;/h3-6H2,1-2H3;.
What are the key properties of hexane;molybdenum?
hexane;molybdenum has a molecular weight of 182.12 g/mol, XLogP of 2.58, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hexane;molybdenum is sourced from PubChem (CID 162092649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).