copper bis(2-carboxyphenolate)

C14H10CuO6 — CID 54683201

IUPACcopper bis(2-carboxyphenolate)
SMILESO=C(O)c1ccccc1[O-].O=C(O)c1ccccc1[O-].[Cu+2]
InChIInChI=1S/2C7H6O3.Cu/c2*8-6-4-2-1-3-5(6)7(9)10;/h2*1-4,8H,(H,9,10);/q;;+2/p-2
InChIKeyCMRVDFLZXRTMTH-UHFFFAOYSA-L
MW337.77 g/mol
LogP0.91
Rot. Bonds2

About copper bis(2-carboxyphenolate)

copper bis(2-carboxyphenolate) (PubChem CID 54683201) has the molecular formula C14H10CuO6 and a molecular weight of 337.77 g/mol. Its IUPAC name is copper bis(2-carboxyphenolate).

Molecular Properties

Compound Namecopper bis(2-carboxyphenolate)
PubChem CID54683201
Molecular FormulaC14H10CuO6
Molecular Weight337.77 g/mol
Exact Mass336.98
IUPAC Namecopper bis(2-carboxyphenolate)
SMILESO=C(O)c1ccccc1[O-].O=C(O)c1ccccc1[O-].[Cu+2]
InChIInChI=1S/2C7H6O3.Cu/c2*8-6-4-2-1-3-5(6)7(9)10;/h2*1-4,8H,(H,9,10);/q;;+2/p-2
InChIKeyCMRVDFLZXRTMTH-UHFFFAOYSA-L
XLogP0.91
TPSA120.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.77
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-carboxyphenolate;gold(1+)
CID 54682314
dimagnesium;tetrakis(2-carboxyphenolate)
CID 158207180
potassium 2-carboxyphenolate
CID 23689489
dicalcium bis(2-carboxyphenolate)
CID 158572383
magnesium tris(2-carboxyphenolate)
CID 54714197
dilithium bis(2-carboxyphenolate)
CID 54690284
triazanium;tris(2-carboxyphenolate)
CID 172802459
magnesium bis(2-carboxyphenolate)
CID 54684589
2-carboxyphenolate carbonate
CID 54676053
magnesium;bis(2-carboxyphenolate);trihydrate
CID 172729284
diazanium;bis(2-carboxyphenolate);oxovanadium
CID 173457908
2-carboxyphenolate;ethane;methane
CID 158005371

Frequently Asked Questions

What is the IUPAC name of copper bis(2-carboxyphenolate)?
The IUPAC name of copper bis(2-carboxyphenolate) (CID 54683201) is copper bis(2-carboxyphenolate).
What is the SMILES notation for copper bis(2-carboxyphenolate)?
The canonical SMILES for copper bis(2-carboxyphenolate) is O=C(O)c1ccccc1[O-].O=C(O)c1ccccc1[O-].[Cu+2].
What is the InChIKey of copper bis(2-carboxyphenolate)?
The InChIKey is CMRVDFLZXRTMTH-UHFFFAOYSA-L. The full InChI is InChI=1S/2C7H6O3.Cu/c2*8-6-4-2-1-3-5(6)7(9)10;/h2*1-4,8H,(H,9,10);/q;;+2/p-2.
What are the key properties of copper bis(2-carboxyphenolate)?
copper bis(2-carboxyphenolate) has a molecular weight of 337.77 g/mol, XLogP of 0.91, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for copper bis(2-carboxyphenolate) is sourced from PubChem (CID 54683201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).