copper;bis(2-hydroxy-3-methoxybenzaldehyde)

C16H16CuO6 — CID 50897387

IUPACcopper;bis(2-hydroxy-3-methoxybenzaldehyde)
SMILESCOc1cccc(C=O)c1O.COc1cccc(C=O)c1O.[Cu]
InChIInChI=1S/2C8H8O3.Cu/c2*1-11-7-4-2-3-6(5-9)8(7)10;/h2*2-5,10H,1H3;
InChIKeyMYSDKVBGJDYJAU-UHFFFAOYSA-N
MW367.84 g/mol
LogP2.42
Rot. Bonds4

About copper;bis(2-hydroxy-3-methoxybenzaldehyde)

copper;bis(2-hydroxy-3-methoxybenzaldehyde) (PubChem CID 50897387) has the molecular formula C16H16CuO6 and a molecular weight of 367.84 g/mol. Its IUPAC name is copper;bis(2-hydroxy-3-methoxybenzaldehyde).

Molecular Properties

Compound Namecopper;bis(2-hydroxy-3-methoxybenzaldehyde)
PubChem CID50897387
Molecular FormulaC16H16CuO6
Molecular Weight367.84 g/mol
Exact Mass367.02
IUPAC Namecopper;bis(2-hydroxy-3-methoxybenzaldehyde)
SMILESCOc1cccc(C=O)c1O.COc1cccc(C=O)c1O.[Cu]
InChIInChI=1S/2C8H8O3.Cu/c2*1-11-7-4-2-3-6(5-9)8(7)10;/h2*2-5,10H,1H3;
InChIKeyMYSDKVBGJDYJAU-UHFFFAOYSA-N
XLogP2.42
TPSA93.06 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.84
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-hydroxy-3-methoxybenzaldehyde
CID 8991
2-hydroxy-3-methoxybenzaldehyde;methane
CID 165075137
ethene;2-hydroxy-3-methoxybenzaldehyde
CID 175162627
1-aminopropan-2-ol;2-hydroxy-3-methoxybenzaldehyde
CID 19867153
6-bromo-2-hydroxy-3-methoxybenzaldehyde;2-hydroxy-3-methoxybenzaldehyde
CID 160668969
2-hydroxy-3-methoxybenzaldehyde;pyridine-3-carboxylic acid
CID 175442040
2-(2-formyl-6-methoxyphenyl)-3-methoxybenzaldehyde
CID 15694387
2-[(E)-[(E)-(2-hydroxy-3-methoxyphenyl)methylidenehydrazinylidene]methyl]-6-methoxyphenol
CID 135473163
2-[(E)-hydroxyiminomethyl]-6-methoxyphenol
CID 135460299
2-hydroxy-3-(2-methylphenoxy)benzaldehyde
CID 13066661
S-(2-formyl-6-methoxyphenyl) ethanethioate
CID 91264360
2-methoxy-6-(methoxyiminomethyl)phenol
CID 530390

Frequently Asked Questions

What is the IUPAC name of copper;bis(2-hydroxy-3-methoxybenzaldehyde)?
The IUPAC name of copper;bis(2-hydroxy-3-methoxybenzaldehyde) (CID 50897387) is copper;bis(2-hydroxy-3-methoxybenzaldehyde).
What is the SMILES notation for copper;bis(2-hydroxy-3-methoxybenzaldehyde)?
The canonical SMILES for copper;bis(2-hydroxy-3-methoxybenzaldehyde) is COc1cccc(C=O)c1O.COc1cccc(C=O)c1O.[Cu].
What is the InChIKey of copper;bis(2-hydroxy-3-methoxybenzaldehyde)?
The InChIKey is MYSDKVBGJDYJAU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H8O3.Cu/c2*1-11-7-4-2-3-6(5-9)8(7)10;/h2*2-5,10H,1H3;.
What are the key properties of copper;bis(2-hydroxy-3-methoxybenzaldehyde)?
copper;bis(2-hydroxy-3-methoxybenzaldehyde) has a molecular weight of 367.84 g/mol, XLogP of 2.42, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for copper;bis(2-hydroxy-3-methoxybenzaldehyde) is sourced from PubChem (CID 50897387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).