dibromo(propoxy)alumane

C3H7AlBr2O — CID 139634122

IUPACdibromo(propoxy)alumane
SMILESCCCO[Al](Br)Br
InChIInChI=1S/C3H7O.Al.2BrH/c1-2-3-4;;;/h2-3H2,1H3;;2*1H/q-1;+3;;/p-2
InChIKeyKBOGOGHSBSSGRI-UHFFFAOYSA-L
MW245.88 g/mol
LogP2.19
Rot. Bonds3

About dibromo(propoxy)alumane

dibromo(propoxy)alumane (PubChem CID 139634122) has the molecular formula C3H7AlBr2O and a molecular weight of 245.88 g/mol. Its IUPAC name is dibromo(propoxy)alumane.

Molecular Properties

Compound Namedibromo(propoxy)alumane
PubChem CID139634122
Molecular FormulaC3H7AlBr2O
Molecular Weight245.88 g/mol
Exact Mass243.87
IUPAC Namedibromo(propoxy)alumane
SMILESCCCO[Al](Br)Br
InChIInChI=1S/C3H7O.Al.2BrH/c1-2-3-4;;;/h2-3H2,1H3;;2*1H/q-1;+3;;/p-2
InChIKeyKBOGOGHSBSSGRI-UHFFFAOYSA-L
XLogP2.19
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.88
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

methyl-propoxy-propylalumane
CID 59936800
propan-2-ol;tripropoxyalumane
CID 159839626
1-[methyl(propoxy)phosphoryl]oxypropane
CID 566276
propoxygermane
CID 154156354
ethane;propane;1-propoxypropane
CID 143757970
1-(1-bromoethenoxy)propane
CID 59930688
butoxy(dimethyl)alumane
CID 16697704
pentapropoxy-λ5-stibane
CID 16703362
potassium 1-oxidooxypropane
CID 18736906
ethane;1-methoxypropane;propane
CID 145001283
CID 173026509
CID 173026509
1-propoxy-3-(3-propoxypropoxy)propane
CID 90943526

Frequently Asked Questions

What is the IUPAC name of dibromo(propoxy)alumane?
The IUPAC name of dibromo(propoxy)alumane (CID 139634122) is dibromo(propoxy)alumane.
What is the SMILES notation for dibromo(propoxy)alumane?
The canonical SMILES for dibromo(propoxy)alumane is CCCO[Al](Br)Br.
What is the InChIKey of dibromo(propoxy)alumane?
The InChIKey is KBOGOGHSBSSGRI-UHFFFAOYSA-L. The full InChI is InChI=1S/C3H7O.Al.2BrH/c1-2-3-4;;;/h2-3H2,1H3;;2*1H/q-1;+3;;/p-2.
What are the key properties of dibromo(propoxy)alumane?
dibromo(propoxy)alumane has a molecular weight of 245.88 g/mol, XLogP of 2.19, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dibromo(propoxy)alumane is sourced from PubChem (CID 139634122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).