3,7,11,15-tetramethylhexadecylgallane

C20H43Ga — CID 174707879

IUPAC3,7,11,15-tetramethylhexadecylgallane
SMILESCC(C)CCCC(C)CCCC(C)CCCC(C)CC[GaH2]
InChIInChI=1S/C20H41.Ga.2H/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3;;;/h17-20H,1,7-16H2,2-6H3;;;
InChIKeyVOHSLRULPNSSBE-UHFFFAOYSA-N
MW353.29 g/mol
LogP6.50
Rot. Bonds14

About 3,7,11,15-tetramethylhexadecylgallane

3,7,11,15-tetramethylhexadecylgallane (PubChem CID 174707879) has the molecular formula C20H43Ga and a molecular weight of 353.29 g/mol. Its IUPAC name is 3,7,11,15-tetramethylhexadecylgallane.

Molecular Properties

Compound Name3,7,11,15-tetramethylhexadecylgallane
PubChem CID174707879
Molecular FormulaC20H43Ga
Molecular Weight353.29 g/mol
Exact Mass352.26
IUPAC Name3,7,11,15-tetramethylhexadecylgallane
SMILESCC(C)CCCC(C)CCCC(C)CCCC(C)CC[GaH2]
InChIInChI=1S/C20H41.Ga.2H/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3;;;/h17-20H,1,7-16H2,2-6H3;;;
InChIKeyVOHSLRULPNSSBE-UHFFFAOYSA-N
XLogP6.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds14
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500353.29
LogP ≤ 56.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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(3R)-3,7-dimethyloctan-1-amine
CID 92974894
2,6-dimethylundecane
CID 28453
2,6,10,15,19-pentamethylhenicosane
CID 6428617
(2S,6S)-6,10-dimethylundecan-2-ol
CID 92938997
2,6,10,14,19,23-hexamethylhexacosane
CID 6428620
(2R,6R,10R)-2,6,10,14-tetramethylpentadecan-1-ol
CID 170847769
3,7-dimethyloctan-1-ol
CID 7792
2,6-dimethyltridecane
CID 524061
2,4,10,15,19,23-hexamethyltetracosane
CID 71327414

Frequently Asked Questions

What is the IUPAC name of 3,7,11,15-tetramethylhexadecylgallane?
The IUPAC name of 3,7,11,15-tetramethylhexadecylgallane (CID 174707879) is 3,7,11,15-tetramethylhexadecylgallane.
What is the SMILES notation for 3,7,11,15-tetramethylhexadecylgallane?
The canonical SMILES for 3,7,11,15-tetramethylhexadecylgallane is CC(C)CCCC(C)CCCC(C)CCCC(C)CC[GaH2].
What is the InChIKey of 3,7,11,15-tetramethylhexadecylgallane?
The InChIKey is VOHSLRULPNSSBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H41.Ga.2H/c1-7-18(4)12-9-14-20(6)16-10-15-19(5)13-8-11-17(2)3;;;/h17-20H,1,7-16H2,2-6H3;;;.
What are the key properties of 3,7,11,15-tetramethylhexadecylgallane?
3,7,11,15-tetramethylhexadecylgallane has a molecular weight of 353.29 g/mol, XLogP of 6.50, 14 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7,11,15-tetramethylhexadecylgallane is sourced from PubChem (CID 174707879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).