chloro(diethyl)alumane;methanamine;hydrochloride

C5H16AlCl2N — CID 174725150

IUPACchloro(diethyl)alumane;methanamine;hydrochloride
SMILESCC[Al](Cl)CC.CN.Cl
InChIInChI=1S/2C2H5.CH5N.Al.2ClH/c3*1-2;;;/h2*1H2,2H3;2H2,1H3;;2*1H/q;;;+1;;/p-1
InChIKeyLIWOXFVHYVRZLJ-UHFFFAOYSA-M
MW188.08 g/mol
LogP2.25
Rot. Bonds2

About chloro(diethyl)alumane;methanamine;hydrochloride

chloro(diethyl)alumane;methanamine;hydrochloride (PubChem CID 174725150) has the molecular formula C5H16AlCl2N and a molecular weight of 188.08 g/mol. Its IUPAC name is chloro(diethyl)alumane;methanamine;hydrochloride.

Molecular Properties

Compound Namechloro(diethyl)alumane;methanamine;hydrochloride
PubChem CID174725150
Molecular FormulaC5H16AlCl2N
Molecular Weight188.08 g/mol
Exact Mass187.05
IUPAC Namechloro(diethyl)alumane;methanamine;hydrochloride
SMILESCC[Al](Cl)CC.CN.Cl
InChIInChI=1S/2C2H5.CH5N.Al.2ClH/c3*1-2;;;/h2*1H2,2H3;2H2,1H3;;2*1H/q;;;+1;;/p-1
InChIKeyLIWOXFVHYVRZLJ-UHFFFAOYSA-M
XLogP2.25
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.08
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of chloro(diethyl)alumane;methanamine;hydrochloride?
The IUPAC name of chloro(diethyl)alumane;methanamine;hydrochloride (CID 174725150) is chloro(diethyl)alumane;methanamine;hydrochloride.
What is the SMILES notation for chloro(diethyl)alumane;methanamine;hydrochloride?
The canonical SMILES for chloro(diethyl)alumane;methanamine;hydrochloride is CC[Al](Cl)CC.CN.Cl.
What is the InChIKey of chloro(diethyl)alumane;methanamine;hydrochloride?
The InChIKey is LIWOXFVHYVRZLJ-UHFFFAOYSA-M. The full InChI is InChI=1S/2C2H5.CH5N.Al.2ClH/c3*1-2;;;/h2*1H2,2H3;2H2,1H3;;2*1H/q;;;+1;;/p-1.
What are the key properties of chloro(diethyl)alumane;methanamine;hydrochloride?
chloro(diethyl)alumane;methanamine;hydrochloride has a molecular weight of 188.08 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro(diethyl)alumane;methanamine;hydrochloride is sourced from PubChem (CID 174725150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).