acetic acid;gallane;tetrahydrate

C2H15GaO6 — CID 175605130

IUPACacetic acid;gallane;tetrahydrate
SMILESCC(=O)O.O.O.O.O.[GaH3]
InChIInChI=1S/C2H4O2.Ga.4H2O.3H/c1-2(3)4;;;;;;;;/h1H3,(H,3,4);;4*1H2;;;
InChIKeyDUDFRBWVDVVRPG-UHFFFAOYSA-N
MW204.86 g/mol
LogP-4.39
Rot. Bonds

About acetic acid;gallane;tetrahydrate

acetic acid;gallane;tetrahydrate (PubChem CID 175605130) has the molecular formula C2H15GaO6 and a molecular weight of 204.86 g/mol. Its IUPAC name is acetic acid;gallane;tetrahydrate.

Molecular Properties

Compound Nameacetic acid;gallane;tetrahydrate
PubChem CID175605130
Molecular FormulaC2H15GaO6
Molecular Weight204.86 g/mol
Exact Mass204.01
IUPAC Nameacetic acid;gallane;tetrahydrate
SMILESCC(=O)O.O.O.O.O.[GaH3]
InChIInChI=1S/C2H4O2.Ga.4H2O.3H/c1-2(3)4;;;;;;;;/h1H3,(H,3,4);;4*1H2;;;
InChIKeyDUDFRBWVDVVRPG-UHFFFAOYSA-N
XLogP-4.39
TPSA163.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.86
LogP ≤ 5-4.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of acetic acid;gallane;tetrahydrate?
The IUPAC name of acetic acid;gallane;tetrahydrate (CID 175605130) is acetic acid;gallane;tetrahydrate.
What is the SMILES notation for acetic acid;gallane;tetrahydrate?
The canonical SMILES for acetic acid;gallane;tetrahydrate is CC(=O)O.O.O.O.O.[GaH3].
What is the InChIKey of acetic acid;gallane;tetrahydrate?
The InChIKey is DUDFRBWVDVVRPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4O2.Ga.4H2O.3H/c1-2(3)4;;;;;;;;/h1H3,(H,3,4);;4*1H2;;;.
What are the key properties of acetic acid;gallane;tetrahydrate?
acetic acid;gallane;tetrahydrate has a molecular weight of 204.86 g/mol, XLogP of -4.39, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;gallane;tetrahydrate is sourced from PubChem (CID 175605130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).