CID 173007307

C2H8AlO4 — CID 173007307

IUPAC—
SMILESCC(=O)O.O.O.[Al]
InChIInChI=1S/C2H4O2.Al.2H2O/c1-2(3)4;;;/h1H3,(H,3,4);;2*1H2
InChIKeyYRZNXUVMUPNJEZ-UHFFFAOYSA-N
MW123.06 g/mol
LogP-1.94
Rot. Bonds

About CID 173007307

CID 173007307 (PubChem CID 173007307) has the molecular formula C2H8AlO4 and a molecular weight of 123.06 g/mol.

Molecular Properties

Compound NameCID 173007307
PubChem CID173007307
Molecular FormulaC2H8AlO4
Molecular Weight123.06 g/mol
Exact Mass123.02
IUPAC Name—
SMILESCC(=O)O.O.O.[Al]
InChIInChI=1S/C2H4O2.Al.2H2O/c1-2(3)4;;;/h1H3,(H,3,4);;2*1H2
InChIKeyYRZNXUVMUPNJEZ-UHFFFAOYSA-N
XLogP-1.94
TPSA100.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.06
LogP ≤ 5-1.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of CID 173007307?
The IUPAC name of CID 173007307 (CID 173007307) is not available.
What is the SMILES notation for CID 173007307?
The canonical SMILES for CID 173007307 is CC(=O)O.O.O.[Al].
What is the InChIKey of CID 173007307?
The InChIKey is YRZNXUVMUPNJEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H4O2.Al.2H2O/c1-2(3)4;;;/h1H3,(H,3,4);;2*1H2.
What are the key properties of CID 173007307?
CID 173007307 has a molecular weight of 123.06 g/mol, XLogP of -1.94, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for CID 173007307 is sourced from PubChem (CID 173007307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).