dichloro-[(2-formylphenyl)methylidene]ruthenium

C8H6Cl2ORu — CID 15984754

IUPACdichloro-[(2-formylphenyl)methylidene]ruthenium
SMILESO=Cc1ccccc1C=[Ru](Cl)Cl
InChIInChI=1S/C8H6O.2ClH.Ru/c1-7-4-2-3-5-8(7)6-9;;;/h1-6H;2*1H;/q;;;+2/p-2
InChIKeyOVPXHAWEFQQCET-UHFFFAOYSA-L
MW290.11 g/mol
LogP2.58
Rot. Bonds2

About dichloro-[(2-formylphenyl)methylidene]ruthenium

dichloro-[(2-formylphenyl)methylidene]ruthenium (PubChem CID 15984754) has the molecular formula C8H6Cl2ORu and a molecular weight of 290.11 g/mol. Its IUPAC name is dichloro-[(2-formylphenyl)methylidene]ruthenium.

Molecular Properties

Compound Namedichloro-[(2-formylphenyl)methylidene]ruthenium
PubChem CID15984754
Molecular FormulaC8H6Cl2ORu
Molecular Weight290.11 g/mol
Exact Mass289.88
IUPAC Namedichloro-[(2-formylphenyl)methylidene]ruthenium
SMILESO=Cc1ccccc1C=[Ru](Cl)Cl
InChIInChI=1S/C8H6O.2ClH.Ru/c1-7-4-2-3-5-8(7)6-9;;;/h1-6H;2*1H;/q;;;+2/p-2
InChIKeyOVPXHAWEFQQCET-UHFFFAOYSA-L
XLogP2.58
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.11
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

dihydroxy(dioxo)chromium;phthalaldehyde
CID 174903240
2-[2-(oxo(113C)methyl)phenyl](13C2)benzaldehyde
CID 169434237
2-bis(2-formylphenyl)phosphanylbenzaldehyde
CID 71366450
CID 158421076
CID 158421076
2-[(E)-2-hydroxyethenyl]benzaldehyde
CID 98052908
bis(2-formylphenolate);palladium(2+)
CID 165347801
2-hydroxybenzaldehyde;nickel(2+)
CID 18320961
2-stannylbenzaldehyde
CID 154487471
carbon monoxide;chromium;2-ethenylbenzaldehyde
CID 11140117
ethene;2-hydroxybenzaldehyde
CID 23043417
potassium 2-formylbenzenethiolate
CID 101455951
sodium;hydride;2-hydroxybenzaldehyde
CID 173406661

Frequently Asked Questions

What is the IUPAC name of dichloro-[(2-formylphenyl)methylidene]ruthenium?
The IUPAC name of dichloro-[(2-formylphenyl)methylidene]ruthenium (CID 15984754) is dichloro-[(2-formylphenyl)methylidene]ruthenium.
What is the SMILES notation for dichloro-[(2-formylphenyl)methylidene]ruthenium?
The canonical SMILES for dichloro-[(2-formylphenyl)methylidene]ruthenium is O=Cc1ccccc1C=[Ru](Cl)Cl.
What is the InChIKey of dichloro-[(2-formylphenyl)methylidene]ruthenium?
The InChIKey is OVPXHAWEFQQCET-UHFFFAOYSA-L. The full InChI is InChI=1S/C8H6O.2ClH.Ru/c1-7-4-2-3-5-8(7)6-9;;;/h1-6H;2*1H;/q;;;+2/p-2.
What are the key properties of dichloro-[(2-formylphenyl)methylidene]ruthenium?
dichloro-[(2-formylphenyl)methylidene]ruthenium has a molecular weight of 290.11 g/mol, XLogP of 2.58, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-[(2-formylphenyl)methylidene]ruthenium is sourced from PubChem (CID 15984754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).