carbon monoxide;[furan-2-yl-(4-methoxyphenoxy)methylidene]chromium

C15H10CrO6 — CID 134877716

IUPACcarbon monoxide;[furan-2-yl-(4-methoxyphenoxy)methylidene]chromium
SMILESCOc1ccc(OC(=[Cr])c2ccco2)cc1.[C-]#[O+].[C-]#[O+].[C-]#[O+]
InChIInChI=1S/C12H10O3.3CO.Cr/c1-13-10-4-6-11(7-5-10)15-9-12-3-2-8-14-12;3*1-2;/h2-8H,1H3;;;;
InChIKeyQNKSJBFXVGJKJF-UHFFFAOYSA-N
MW338.24 g/mol
LogP2.28
Rot. Bonds4

About carbon monoxide;[furan-2-yl-(4-methoxyphenoxy)methylidene]chromium

carbon monoxide;[furan-2-yl-(4-methoxyphenoxy)methylidene]chromium (PubChem CID 134877716) has the molecular formula C15H10CrO6 and a molecular weight of 338.24 g/mol. Its IUPAC name is carbon monoxide;[furan-2-yl-(4-methoxyphenoxy)methylidene]chromium.

Molecular Properties

Compound Namecarbon monoxide;[furan-2-yl-(4-methoxyphenoxy)methylidene]chromium
PubChem CID134877716
Molecular FormulaC15H10CrO6
Molecular Weight338.24 g/mol
Exact Mass337.99
IUPAC Namecarbon monoxide;[furan-2-yl-(4-methoxyphenoxy)methylidene]chromium
SMILESCOc1ccc(OC(=[Cr])c2ccco2)cc1.[C-]#[O+].[C-]#[O+].[C-]#[O+]
InChIInChI=1S/C12H10O3.3CO.Cr/c1-13-10-4-6-11(7-5-10)15-9-12-3-2-8-14-12;3*1-2;/h2-8H,1H3;;;;
InChIKeyQNKSJBFXVGJKJF-UHFFFAOYSA-N
XLogP2.28
TPSA91.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.24
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}

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Related Compounds

carbon monoxide;[furan-2-yl-[3-(trifluoromethyl)phenoxy]methylidene]chromium
CID 10982903
[2-(4-methoxybenzoyl)oxyphenyl] furan-2-carboxylate
CID 91715138
N-[(1S)-1-(4-methoxyphenyl)-2-methylpropyl]furan-2-carboxamide
CID 40938970
carbon monoxide;[methoxy-(4-methoxyphenyl)methylidene]chromium
CID 10882418
(4-propan-2-ylphenyl) furan-2-carboxylate
CID 723691
ethyl 4-(furan-2-yl)-3-(4-methoxyphenyl)-4-oxobutanoate
CID 165348272
N-[2-[(4-methoxyphenyl)carbamoyl]phenyl]furan-2-carboxamide
CID 722971
(2-chloro-4-methoxyphenyl)-(furan-2-yl)methanone
CID 21430685
O-(4-methylphenyl) furan-2-carbothioate
CID 100928361
furan-2-yl-[4-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]methanone
CID 3159762
[4-[(E)-[[2-(4-methoxyanilino)-2-oxoacetyl]hydrazinylidene]methyl]phenyl] furan-2-carboxylate
CID 19660610
methyl (Z)-2-(furan-2-carbonylamino)-3-(4-methoxyphenyl)prop-2-enoate
CID 2180781

Frequently Asked Questions

What is the IUPAC name of carbon monoxide;[furan-2-yl-(4-methoxyphenoxy)methylidene]chromium?
The IUPAC name of carbon monoxide;[furan-2-yl-(4-methoxyphenoxy)methylidene]chromium (CID 134877716) is carbon monoxide;[furan-2-yl-(4-methoxyphenoxy)methylidene]chromium.
What is the SMILES notation for carbon monoxide;[furan-2-yl-(4-methoxyphenoxy)methylidene]chromium?
The canonical SMILES for carbon monoxide;[furan-2-yl-(4-methoxyphenoxy)methylidene]chromium is COc1ccc(OC(=[Cr])c2ccco2)cc1.[C-]#[O+].[C-]#[O+].[C-]#[O+].
What is the InChIKey of carbon monoxide;[furan-2-yl-(4-methoxyphenoxy)methylidene]chromium?
The InChIKey is QNKSJBFXVGJKJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10O3.3CO.Cr/c1-13-10-4-6-11(7-5-10)15-9-12-3-2-8-14-12;3*1-2;/h2-8H,1H3;;;;.
What are the key properties of carbon monoxide;[furan-2-yl-(4-methoxyphenoxy)methylidene]chromium?
carbon monoxide;[furan-2-yl-(4-methoxyphenoxy)methylidene]chromium has a molecular weight of 338.24 g/mol, XLogP of 2.28, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for carbon monoxide;[furan-2-yl-(4-methoxyphenoxy)methylidene]chromium is sourced from PubChem (CID 134877716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).