2-dimethylalumanyloxyethanol

C4H11AlO2 — CID 59922379

IUPAC2-dimethylalumanyloxyethanol
SMILESC[Al](C)OCCO
InChIInChI=1S/C2H5O2.2CH3.Al/c3-1-2-4;;;/h3H,1-2H2;2*1H3;/q-1;;;+1
InChIKeyYEFPBBNZCCTITQ-UHFFFAOYSA-N
MW118.11 g/mol
LogP0.25
Rot. Bonds3

About 2-dimethylalumanyloxyethanol

2-dimethylalumanyloxyethanol (PubChem CID 59922379) has the molecular formula C4H11AlO2 and a molecular weight of 118.11 g/mol. Its IUPAC name is 2-dimethylalumanyloxyethanol.

Molecular Properties

Compound Name2-dimethylalumanyloxyethanol
PubChem CID59922379
Molecular FormulaC4H11AlO2
Molecular Weight118.11 g/mol
Exact Mass118.06
IUPAC Name2-dimethylalumanyloxyethanol
SMILESC[Al](C)OCCO
InChIInChI=1S/C2H5O2.2CH3.Al/c3-1-2-4;;;/h3H,1-2H2;2*1H3;/q-1;;;+1
InChIKeyYEFPBBNZCCTITQ-UHFFFAOYSA-N
XLogP0.25
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.11
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-hydroxyethylperoxy)ethanol;methoxymethane
CID 174905336
sodium 2-methoxyethanol
CID 21124383
ethane;2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol
CID 159638520
2-methoxyethanol;sulfane
CID 174965249
2-hydroxyethyl hypochlorite;hydrochloride
CID 175048980
bismuthane;2-methoxyethanol
CID 174782924
ethane;2-methoxyethanol
CID 175109361
butan-1-ol;2-(2-hydroxyethylperoxy)ethanol
CID 174670759
1,2-dimethoxyethane;ethane-1,2-diol;tris(2-methoxyethanol)
CID 160893759
copper;2-(2-hydroxyethoxyamino)oxyethanol
CID 87653239
2-(4-methoxybut-3-en-2-yloxy)ethanol
CID 76540714
2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 17472

Frequently Asked Questions

What is the IUPAC name of 2-dimethylalumanyloxyethanol?
The IUPAC name of 2-dimethylalumanyloxyethanol (CID 59922379) is 2-dimethylalumanyloxyethanol.
What is the SMILES notation for 2-dimethylalumanyloxyethanol?
The canonical SMILES for 2-dimethylalumanyloxyethanol is C[Al](C)OCCO.
What is the InChIKey of 2-dimethylalumanyloxyethanol?
The InChIKey is YEFPBBNZCCTITQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5O2.2CH3.Al/c3-1-2-4;;;/h3H,1-2H2;2*1H3;/q-1;;;+1.
What are the key properties of 2-dimethylalumanyloxyethanol?
2-dimethylalumanyloxyethanol has a molecular weight of 118.11 g/mol, XLogP of 0.25, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dimethylalumanyloxyethanol is sourced from PubChem (CID 59922379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).