alumane;1,4-diethylbenzene

C10H17Al — CID 174296012

IUPACalumane;1,4-diethylbenzene
SMILESCCc1ccc(CC)cc1.[AlH3]
InChIInChI=1S/C10H14.Al.3H/c1-3-9-5-7-10(4-2)8-6-9;;;;/h5-8H,3-4H2,1-2H3;;;;
InChIKeyJMKQRGPEUOKRMK-UHFFFAOYSA-N
MW164.23 g/mol
LogP1.63
Rot. Bonds2

About alumane;1,4-diethylbenzene

alumane;1,4-diethylbenzene (PubChem CID 174296012) has the molecular formula C10H17Al and a molecular weight of 164.23 g/mol. Its IUPAC name is alumane;1,4-diethylbenzene.

Molecular Properties

Compound Namealumane;1,4-diethylbenzene
PubChem CID174296012
Molecular FormulaC10H17Al
Molecular Weight164.23 g/mol
Exact Mass164.11
IUPAC Namealumane;1,4-diethylbenzene
SMILESCCc1ccc(CC)cc1.[AlH3]
InChIInChI=1S/C10H14.Al.3H/c1-3-9-5-7-10(4-2)8-6-9;;;;/h5-8H,3-4H2,1-2H3;;;;
InChIKeyJMKQRGPEUOKRMK-UHFFFAOYSA-N
XLogP1.63
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.23
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,4-diethylbenzene;ethane
CID 91207141
1,4-diethylbenzene;ethane;methane
CID 166131756
1,4-diethylbenzene;oxoalumane
CID 174317758
1-ethyl-4-[2-[4-[2-[4-[2-[4-[2-[4-[2-(4-ethylphenyl)ethyl]phenyl]ethyl]phenyl]ethyl]phenyl]ethyl]phenyl]ethyl]benzene
CID 102370536
CID 57436075
CID 57436075
bis(1-ethyl-4-methylbenzene);hydrate
CID 175281588
1,4-diethylbenzene;heptane
CID 175370860
1-ethyl-4-methylbenzene;propane
CID 144580802
1-bromo-4-ethylbenzene
CID 15313
1-N,1-N,4-N,4-N-tetrakis(4-ethylphenyl)benzene-1,4-diamine
CID 58862530
ethylcyclodecapentaene
CID 90861705
4-ethylaniline;hydrobromide
CID 86059477

Frequently Asked Questions

What is the IUPAC name of alumane;1,4-diethylbenzene?
The IUPAC name of alumane;1,4-diethylbenzene (CID 174296012) is alumane;1,4-diethylbenzene.
What is the SMILES notation for alumane;1,4-diethylbenzene?
The canonical SMILES for alumane;1,4-diethylbenzene is CCc1ccc(CC)cc1.[AlH3].
What is the InChIKey of alumane;1,4-diethylbenzene?
The InChIKey is JMKQRGPEUOKRMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14.Al.3H/c1-3-9-5-7-10(4-2)8-6-9;;;;/h5-8H,3-4H2,1-2H3;;;;.
What are the key properties of alumane;1,4-diethylbenzene?
alumane;1,4-diethylbenzene has a molecular weight of 164.23 g/mol, XLogP of 1.63, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for alumane;1,4-diethylbenzene is sourced from PubChem (CID 174296012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).