dibromo-(3,3-diethyl-2-methylpentan-2-yl)alumane

C10H21AlBr2 — CID 139836923

IUPACdibromo-(3,3-diethyl-2-methylpentan-2-yl)alumane
SMILESCCC(CC)(CC)C(C)(C)[Al](Br)Br
InChIInChI=1S/C10H21.Al.2BrH/c1-6-10(7-2,8-3)9(4)5;;;/h6-8H2,1-5H3;;2*1H/q;+2;;/p-2
InChIKeyUYRKCOYHGZLJJY-UHFFFAOYSA-L
MW328.07 g/mol
LogP5.26
Rot. Bonds5

About dibromo-(3,3-diethyl-2-methylpentan-2-yl)alumane

dibromo-(3,3-diethyl-2-methylpentan-2-yl)alumane (PubChem CID 139836923) has the molecular formula C10H21AlBr2 and a molecular weight of 328.07 g/mol. Its IUPAC name is dibromo-(3,3-diethyl-2-methylpentan-2-yl)alumane.

Molecular Properties

Compound Namedibromo-(3,3-diethyl-2-methylpentan-2-yl)alumane
PubChem CID139836923
Molecular FormulaC10H21AlBr2
Molecular Weight328.07 g/mol
Exact Mass325.98
IUPAC Namedibromo-(3,3-diethyl-2-methylpentan-2-yl)alumane
SMILESCCC(CC)(CC)C(C)(C)[Al](Br)Br
InChIInChI=1S/C10H21.Al.2BrH/c1-6-10(7-2,8-3)9(4)5;;;/h6-8H2,1-5H3;;2*1H/q;+2;;/p-2
InChIKeyUYRKCOYHGZLJJY-UHFFFAOYSA-L
XLogP5.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.07
LogP ≤ 55.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of dibromo-(3,3-diethyl-2-methylpentan-2-yl)alumane?
The IUPAC name of dibromo-(3,3-diethyl-2-methylpentan-2-yl)alumane (CID 139836923) is dibromo-(3,3-diethyl-2-methylpentan-2-yl)alumane.
What is the SMILES notation for dibromo-(3,3-diethyl-2-methylpentan-2-yl)alumane?
The canonical SMILES for dibromo-(3,3-diethyl-2-methylpentan-2-yl)alumane is CCC(CC)(CC)C(C)(C)[Al](Br)Br.
What is the InChIKey of dibromo-(3,3-diethyl-2-methylpentan-2-yl)alumane?
The InChIKey is UYRKCOYHGZLJJY-UHFFFAOYSA-L. The full InChI is InChI=1S/C10H21.Al.2BrH/c1-6-10(7-2,8-3)9(4)5;;;/h6-8H2,1-5H3;;2*1H/q;+2;;/p-2.
What are the key properties of dibromo-(3,3-diethyl-2-methylpentan-2-yl)alumane?
dibromo-(3,3-diethyl-2-methylpentan-2-yl)alumane has a molecular weight of 328.07 g/mol, XLogP of 5.26, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dibromo-(3,3-diethyl-2-methylpentan-2-yl)alumane is sourced from PubChem (CID 139836923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).