carbon monoxide;[ethoxy(phenyl)methylidene]chromium

C12H10CrO4 — CID 11369238

IUPACcarbon monoxide;[ethoxy(phenyl)methylidene]chromium
SMILESCCOC(=[Cr])c1ccccc1.[C-]#[O+].[C-]#[O+].[C-]#[O+]
InChIInChI=1S/C9H10O.3CO.Cr/c1-2-10-8-9-6-4-3-5-7-9;3*1-2;/h3-7H,2H2,1H3;;;;
InChIKeyIDFWGJDGTAVEFD-UHFFFAOYSA-N
MW270.20 g/mol
LogP1.64
Rot. Bonds3

About carbon monoxide;[ethoxy(phenyl)methylidene]chromium

carbon monoxide;[ethoxy(phenyl)methylidene]chromium (PubChem CID 11369238) has the molecular formula C12H10CrO4 and a molecular weight of 270.20 g/mol. Its IUPAC name is carbon monoxide;[ethoxy(phenyl)methylidene]chromium.

Molecular Properties

Compound Namecarbon monoxide;[ethoxy(phenyl)methylidene]chromium
PubChem CID11369238
Molecular FormulaC12H10CrO4
Molecular Weight270.20 g/mol
Exact Mass270.00
IUPAC Namecarbon monoxide;[ethoxy(phenyl)methylidene]chromium
SMILESCCOC(=[Cr])c1ccccc1.[C-]#[O+].[C-]#[O+].[C-]#[O+]
InChIInChI=1S/C9H10O.3CO.Cr/c1-2-10-8-9-6-4-3-5-7-9;3*1-2;/h3-7H,2H2,1H3;;;;
InChIKeyIDFWGJDGTAVEFD-UHFFFAOYSA-N
XLogP1.64
TPSA68.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.20
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

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CID 158970570
ethyl 2-oxo-2-phenylacetate
CID 15349
diphenylmethanone;ethyl 3-amino-2-hydroxypropanoate
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ethyl (2R)-2-fluoro-3-oxo-3-phenylpropanoate
CID 98056042
ethyl 2,3-diphenylbut-2-enoate
CID 175493323
chloroethane;ethyl benzoate
CID 91175503
ethyl benzoate;toluene
CID 23150750
ethyl (2R)-2-amino-2-phenylacetate
CID 6922658
5-ethoxy-5-oxo-3-phenylpent-3-enoic acid
CID 70049412
1,1,1,2,2,3,3,4,4,4-decafluorobutane;ethyl benzoate
CID 175158553
[ethoxy(phenyl)methylidene]azanium chloride
CID 11030512
ethyl 2-amino-2-phenylacetate chloride
CID 3083657

Frequently Asked Questions

What is the IUPAC name of carbon monoxide;[ethoxy(phenyl)methylidene]chromium?
The IUPAC name of carbon monoxide;[ethoxy(phenyl)methylidene]chromium (CID 11369238) is carbon monoxide;[ethoxy(phenyl)methylidene]chromium.
What is the SMILES notation for carbon monoxide;[ethoxy(phenyl)methylidene]chromium?
The canonical SMILES for carbon monoxide;[ethoxy(phenyl)methylidene]chromium is CCOC(=[Cr])c1ccccc1.[C-]#[O+].[C-]#[O+].[C-]#[O+].
What is the InChIKey of carbon monoxide;[ethoxy(phenyl)methylidene]chromium?
The InChIKey is IDFWGJDGTAVEFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10O.3CO.Cr/c1-2-10-8-9-6-4-3-5-7-9;3*1-2;/h3-7H,2H2,1H3;;;;.
What are the key properties of carbon monoxide;[ethoxy(phenyl)methylidene]chromium?
carbon monoxide;[ethoxy(phenyl)methylidene]chromium has a molecular weight of 270.20 g/mol, XLogP of 1.64, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for carbon monoxide;[ethoxy(phenyl)methylidene]chromium is sourced from PubChem (CID 11369238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).