tripropoxyalumane

C9H21AlO3 — CID 16697137

IUPACtripropoxyalumane
SMILESCCCO[Al](OCCC)OCCC
InChIInChI=1S/3C3H7O.Al/c3*1-2-3-4;/h3*2-3H2,1H3;/q3*-1;+3
InChIKeyOBROYCQXICMORW-UHFFFAOYSA-N
MW204.25 g/mol
LogP2.25
Rot. Bonds9

About tripropoxyalumane

tripropoxyalumane (PubChem CID 16697137) has the molecular formula C9H21AlO3 and a molecular weight of 204.25 g/mol. Its IUPAC name is tripropoxyalumane.

Molecular Properties

Compound Nametripropoxyalumane
PubChem CID16697137
Molecular FormulaC9H21AlO3
Molecular Weight204.25 g/mol
Exact Mass204.13
IUPAC Nametripropoxyalumane
SMILESCCCO[Al](OCCC)OCCC
InChIInChI=1S/3C3H7O.Al/c3*1-2-3-4;/h3*2-3H2,1H3;/q3*-1;+3
InChIKeyOBROYCQXICMORW-UHFFFAOYSA-N
XLogP2.25
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.25
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze tripropoxyalumane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Aluminum isopropoxide
CID 11143
Aluminum butylate
CID 6451513
Aluminum sec-butoxide
CID 61289
Aluminum tributoxide, 95%
CID 16684880
Antimony(III) propoxide
CID 16685265
1-Propanol, 2-methyl-, aluminum salt (3:1)
CID 165121
Aluminum tri-iso-propoxide
CID 16685055
Aluminum(III) s-butoxide
CID 16685157
Dimethyldipropoxygermane
CID 85858239
Tripropoxyarsine
CID 606254
Aluminum isobutylate
CID 16689601
Dibutyl(diethoxy)stannane
CID 16693734

Frequently Asked Questions

What is the IUPAC name of tripropoxyalumane?
The IUPAC name of tripropoxyalumane (CID 16697137) is tripropoxyalumane.
What is the SMILES notation for tripropoxyalumane?
The canonical SMILES for tripropoxyalumane is CCCO[Al](OCCC)OCCC.
What is the InChIKey of tripropoxyalumane?
The InChIKey is OBROYCQXICMORW-UHFFFAOYSA-N. The full InChI is InChI=1S/3C3H7O.Al/c3*1-2-3-4;/h3*2-3H2,1H3;/q3*-1;+3.
What are the key properties of tripropoxyalumane?
tripropoxyalumane has a molecular weight of 204.25 g/mol, XLogP of 2.25, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tripropoxyalumane is sourced from PubChem (CID 16697137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).