bis(2,2-dimethylbutane);tungsten

C12H28W — CID 157126936

IUPACbis(2,2-dimethylbutane);tungsten
SMILESCCC(C)(C)C.CCC(C)(C)C.[W]
InChIInChI=1S/2C6H14.W/c2*1-5-6(2,3)4;/h2*5H2,1-4H3;
InChIKeyAIPORXACDRJWQI-UHFFFAOYSA-N
MW356.20 g/mol
LogP4.88
Rot. Bonds

About bis(2,2-dimethylbutane);tungsten

bis(2,2-dimethylbutane);tungsten (PubChem CID 157126936) has the molecular formula C12H28W and a molecular weight of 356.20 g/mol. Its IUPAC name is bis(2,2-dimethylbutane);tungsten.

Molecular Properties

Compound Namebis(2,2-dimethylbutane);tungsten
PubChem CID157126936
Molecular FormulaC12H28W
Molecular Weight356.20 g/mol
Exact Mass356.17
IUPAC Namebis(2,2-dimethylbutane);tungsten
SMILESCCC(C)(C)C.CCC(C)(C)C.[W]
InChIInChI=1S/2C6H14.W/c2*1-5-6(2,3)4;/h2*5H2,1-4H3;
InChIKeyAIPORXACDRJWQI-UHFFFAOYSA-N
XLogP4.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.20
LogP ≤ 54.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze bis(2,2-dimethylbutane);tungsten with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

pentakis(2,2-dimethylbutane);methane
CID 161368616
tetrakis(2,2-dimethylbutane);methane
CID 158609630
lithium;2,2-dimethylbutane;hydride
CID 174323452
2,2-dimethylbutane;3,3-dimethylpentane
CID 160500141
2,2-dimethylbutane;2-methylbut-2-ene
CID 142603024
azane;2,2-dimethylbutane;propane-1,3-diamine
CID 173127451
2,2-dimethylbutane;2,3-dimethylbutane;3-methylpentane
CID 159848949
2,2-dimethylbutane;propane;2,3,3-trimethylpentane
CID 91438439
1-chloro-1-fluoro-2,2-dimethylpropane;2,2-dimethylbutane
CID 167651170
2,2-dimethylbutane;2,2-dimethylpropane;1,1,1-trifluoro-4,4-dimethylpentane
CID 158100302
2,2-dimethylbutane;2-methylbutane;pentane
CID 158103656
2,2-dimethylbutane;3,3-dimethylbutan-2-ol;2,2,3-trimethylbutane
CID 158901240

Frequently Asked Questions

What is the IUPAC name of bis(2,2-dimethylbutane);tungsten?
The IUPAC name of bis(2,2-dimethylbutane);tungsten (CID 157126936) is bis(2,2-dimethylbutane);tungsten.
What is the SMILES notation for bis(2,2-dimethylbutane);tungsten?
The canonical SMILES for bis(2,2-dimethylbutane);tungsten is CCC(C)(C)C.CCC(C)(C)C.[W].
What is the InChIKey of bis(2,2-dimethylbutane);tungsten?
The InChIKey is AIPORXACDRJWQI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H14.W/c2*1-5-6(2,3)4;/h2*5H2,1-4H3;.
What are the key properties of bis(2,2-dimethylbutane);tungsten?
bis(2,2-dimethylbutane);tungsten has a molecular weight of 356.20 g/mol, XLogP of 4.88, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2,2-dimethylbutane);tungsten is sourced from PubChem (CID 157126936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).