CID 67200510

C12H8MgO4 — CID 67200510

IUPAC—
SMILESO=C(O)c1ccc2cc(C(=O)O)ccc2c1.[Mg]
InChIInChI=1S/C12H8O4.Mg/c13-11(14)9-3-1-7-5-10(12(15)16)4-2-8(7)6-9;/h1-6H,(H,13,14)(H,15,16);
InChIKeyUDDYDPYPRKLYEK-UHFFFAOYSA-N
MW240.50 g/mol
LogP1.86
Rot. Bonds2

About CID 67200510

CID 67200510 (PubChem CID 67200510) has the molecular formula C12H8MgO4 and a molecular weight of 240.50 g/mol.

Molecular Properties

Compound NameCID 67200510
PubChem CID67200510
Molecular FormulaC12H8MgO4
Molecular Weight240.50 g/mol
Exact Mass240.03
IUPAC Name—
SMILESO=C(O)c1ccc2cc(C(=O)O)ccc2c1.[Mg]
InChIInChI=1S/C12H8O4.Mg/c13-11(14)9-3-1-7-5-10(12(15)16)4-2-8(7)6-9;/h1-6H,(H,13,14)(H,15,16);
InChIKeyUDDYDPYPRKLYEK-UHFFFAOYSA-N
XLogP1.86
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.50
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of CID 67200510?
The IUPAC name of CID 67200510 (CID 67200510) is not available.
What is the SMILES notation for CID 67200510?
The canonical SMILES for CID 67200510 is O=C(O)c1ccc2cc(C(=O)O)ccc2c1.[Mg].
What is the InChIKey of CID 67200510?
The InChIKey is UDDYDPYPRKLYEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8O4.Mg/c13-11(14)9-3-1-7-5-10(12(15)16)4-2-8(7)6-9;/h1-6H,(H,13,14)(H,15,16);.
What are the key properties of CID 67200510?
CID 67200510 has a molecular weight of 240.50 g/mol, XLogP of 1.86, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 67200510 is sourced from PubChem (CID 67200510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).