beryllium;hexane;hydride

C6H16Be — CID 173045264

IUPACberyllium;hexane;hydride
SMILESCCCCCC.[Be+2].[H-].[H-]
InChIInChI=1S/C6H14.Be.2H/c1-3-5-6-4-2;;;/h3-6H2,1-2H3;;;/q;+2;2*-1
InChIKeyDBDBFBQWIIRHDE-UHFFFAOYSA-N
MW97.21 g/mol
LogP2.43
Rot. Bonds3

About beryllium;hexane;hydride

beryllium;hexane;hydride (PubChem CID 173045264) has the molecular formula C6H16Be and a molecular weight of 97.21 g/mol. Its IUPAC name is beryllium;hexane;hydride.

Molecular Properties

Compound Nameberyllium;hexane;hydride
PubChem CID173045264
Molecular FormulaC6H16Be
Molecular Weight97.21 g/mol
Exact Mass97.14
IUPAC Nameberyllium;hexane;hydride
SMILESCCCCCC.[Be+2].[H-].[H-]
InChIInChI=1S/C6H14.Be.2H/c1-3-5-6-4-2;;;/h3-6H2,1-2H3;;;/q;+2;2*-1
InChIKeyDBDBFBQWIIRHDE-UHFFFAOYSA-N
XLogP2.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.21
LogP ≤ 52.43
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

magnesium;hexane;hydride
CID 173107039
tetralithium;hexane;hydride
CID 174784043
sodium;hydride;tridecane
CID 172995973
lithium;dodecane;hydride
CID 173115706
trilithium;hydride;icosane
CID 173415382
sodium;octakis(decane);hydride
CID 173398930
hexane;hypochlorous acid
CID 88775298
calcium;hydride;octane
CID 173403164
hexane;tungsten
CID 162105258
azane;hexane
CID 18428977
decane;heptane
CID 159049036
hexacosane;octacosane
CID 158944700

Frequently Asked Questions

What is the IUPAC name of beryllium;hexane;hydride?
The IUPAC name of beryllium;hexane;hydride (CID 173045264) is beryllium;hexane;hydride.
What is the SMILES notation for beryllium;hexane;hydride?
The canonical SMILES for beryllium;hexane;hydride is CCCCCC.[Be+2].[H-].[H-].
What is the InChIKey of beryllium;hexane;hydride?
The InChIKey is DBDBFBQWIIRHDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14.Be.2H/c1-3-5-6-4-2;;;/h3-6H2,1-2H3;;;/q;+2;2*-1.
What are the key properties of beryllium;hexane;hydride?
beryllium;hexane;hydride has a molecular weight of 97.21 g/mol, XLogP of 2.43, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for beryllium;hexane;hydride is sourced from PubChem (CID 173045264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).