CID 170839506

CHMgO4-3 — CID 170839506

IUPAC—
SMILESO=C([O-])[O-].[Mg].[OH-]
InChIInChI=1S/CH2O3.Mg.H2O/c2-1(3)4;;/h(H2,2,3,4);;1H2/p-3
InChIKeyRERJDXWWVICIRN-UHFFFAOYSA-K
MW101.32 g/mol
LogP-3.00
Rot. Bonds

About CID 170839506

CID 170839506 (PubChem CID 170839506) has the molecular formula CHMgO4-3 and a molecular weight of 101.32 g/mol.

Molecular Properties

Compound NameCID 170839506
PubChem CID170839506
Molecular FormulaCHMgO4-3
Molecular Weight101.32 g/mol
Exact Mass100.97
IUPAC Name—
SMILESO=C([O-])[O-].[Mg].[OH-]
InChIInChI=1S/CH2O3.Mg.H2O/c2-1(3)4;;/h(H2,2,3,4);;1H2/p-3
InChIKeyRERJDXWWVICIRN-UHFFFAOYSA-K
XLogP-3.00
TPSA93.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.32
LogP ≤ 5-3.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of CID 170839506?
The IUPAC name of CID 170839506 (CID 170839506) is not available.
What is the SMILES notation for CID 170839506?
The canonical SMILES for CID 170839506 is O=C([O-])[O-].[Mg].[OH-].
What is the InChIKey of CID 170839506?
The InChIKey is RERJDXWWVICIRN-UHFFFAOYSA-K. The full InChI is InChI=1S/CH2O3.Mg.H2O/c2-1(3)4;;/h(H2,2,3,4);;1H2/p-3.
What are the key properties of CID 170839506?
CID 170839506 has a molecular weight of 101.32 g/mol, XLogP of -3.00, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 170839506 is sourced from PubChem (CID 170839506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).