3-methylbutoxygallane

C5H13GaO — CID 174485666

IUPAC3-methylbutoxygallane
SMILESCC(C)CCO[GaH2]
InChIInChI=1S/C5H11O.Ga.2H/c1-5(2)3-4-6;;;/h5H,3-4H2,1-2H3;;;/q-1;+1;;
InChIKeyKYGBWCPYFRUFQI-UHFFFAOYSA-N
MW158.88 g/mol
LogP0.60
Rot. Bonds3

About 3-methylbutoxygallane

3-methylbutoxygallane (PubChem CID 174485666) has the molecular formula C5H13GaO and a molecular weight of 158.88 g/mol. Its IUPAC name is 3-methylbutoxygallane.

Molecular Properties

Compound Name3-methylbutoxygallane
PubChem CID174485666
Molecular FormulaC5H13GaO
Molecular Weight158.88 g/mol
Exact Mass158.02
IUPAC Name3-methylbutoxygallane
SMILESCC(C)CCO[GaH2]
InChIInChI=1S/C5H11O.Ga.2H/c1-5(2)3-4-6;;;/h5H,3-4H2,1-2H3;;;/q-1;+1;;
InChIKeyKYGBWCPYFRUFQI-UHFFFAOYSA-N
XLogP0.60
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.88
LogP ≤ 50.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-methyl-1-[2-[2-[2-[2-[2-(3-methylbutoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]butane
CID 118631027
gallane;3-methyl-1-(3-methylbutoxy)butane
CID 174967258
3-methyl-1-(3-methylbutoxy)butane;molecular iodine
CID 131712143
CID 148792664
CID 148792664
3-methylbutyl hypobromite
CID 141146646
ethane;1-methoxy-3-methylbutane
CID 144580604
3-methylbutoxysilane
CID 123427672
3-methylbutoxyphosphane;hydrobromide
CID 175546648
O-(3-methylbutyl)hydroxylamine chloride
CID 21205587
3-methylbutoxymethanediol
CID 54490534
azane;O-(3-methylbutyl)hydroxylamine;dihydrochloride
CID 173322149
3-methylbutyl nitrite;nitrous acid
CID 89396637

Frequently Asked Questions

What is the IUPAC name of 3-methylbutoxygallane?
The IUPAC name of 3-methylbutoxygallane (CID 174485666) is 3-methylbutoxygallane.
What is the SMILES notation for 3-methylbutoxygallane?
The canonical SMILES for 3-methylbutoxygallane is CC(C)CCO[GaH2].
What is the InChIKey of 3-methylbutoxygallane?
The InChIKey is KYGBWCPYFRUFQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11O.Ga.2H/c1-5(2)3-4-6;;;/h5H,3-4H2,1-2H3;;;/q-1;+1;;.
What are the key properties of 3-methylbutoxygallane?
3-methylbutoxygallane has a molecular weight of 158.88 g/mol, XLogP of 0.60, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylbutoxygallane is sourced from PubChem (CID 174485666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).