methoxy-bis(2-methoxyethoxy)alumane

C7H17AlO5 — CID 16697855

IUPACmethoxy-bis(2-methoxyethoxy)alumane
SMILESCOCCO[Al](OC)OCCOC
InChIInChI=1S/2C3H7O2.CH3O.Al/c2*1-5-3-2-4;1-2;/h2*2-3H2,1H3;1H3;/q3*-1;+3
InChIKeyJZTAPUSWXSLGLC-UHFFFAOYSA-N
MW208.19 g/mol
LogP-0.06
Rot. Bonds9

About methoxy-bis(2-methoxyethoxy)alumane

methoxy-bis(2-methoxyethoxy)alumane (PubChem CID 16697855) has the molecular formula C7H17AlO5 and a molecular weight of 208.19 g/mol. Its IUPAC name is methoxy-bis(2-methoxyethoxy)alumane.

Molecular Properties

Compound Namemethoxy-bis(2-methoxyethoxy)alumane
PubChem CID16697855
Molecular FormulaC7H17AlO5
Molecular Weight208.19 g/mol
Exact Mass208.09
IUPAC Namemethoxy-bis(2-methoxyethoxy)alumane
SMILESCOCCO[Al](OC)OCCOC
InChIInChI=1S/2C3H7O2.CH3O.Al/c2*1-5-3-2-4;1-2;/h2*2-3H2,1H3;1H3;/q3*-1;+3
InChIKeyJZTAPUSWXSLGLC-UHFFFAOYSA-N
XLogP-0.06
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.19
LogP ≤ 5-0.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methoxy-bis(2-methoxyethoxy)alumane?
The IUPAC name of methoxy-bis(2-methoxyethoxy)alumane (CID 16697855) is methoxy-bis(2-methoxyethoxy)alumane.
What is the SMILES notation for methoxy-bis(2-methoxyethoxy)alumane?
The canonical SMILES for methoxy-bis(2-methoxyethoxy)alumane is COCCO[Al](OC)OCCOC.
What is the InChIKey of methoxy-bis(2-methoxyethoxy)alumane?
The InChIKey is JZTAPUSWXSLGLC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H7O2.CH3O.Al/c2*1-5-3-2-4;1-2;/h2*2-3H2,1H3;1H3;/q3*-1;+3.
What are the key properties of methoxy-bis(2-methoxyethoxy)alumane?
methoxy-bis(2-methoxyethoxy)alumane has a molecular weight of 208.19 g/mol, XLogP of -0.06, 9 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-bis(2-methoxyethoxy)alumane is sourced from PubChem (CID 16697855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).