carbon monoxide;[(4-chloro-2,3-dihydrofuran-5-yl)-ethoxymethylidene]chromium

C12H9ClCrO7 — CID 10926242

IUPACcarbon monoxide;[(4-chloro-2,3-dihydrofuran-5-yl)-ethoxymethylidene]chromium
SMILESCCOC(=[Cr])C1=C(Cl)CCO1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+]
InChIInChI=1S/C7H9ClO2.5CO.Cr/c1-2-9-5-7-6(8)3-4-10-7;5*1-2;/h2-4H2,1H3;;;;;;
InChIKeyRZPGMNKUCDASJO-UHFFFAOYSA-N
MW352.65 g/mol
LogP1.38
Rot. Bonds3

About carbon monoxide;[(4-chloro-2,3-dihydrofuran-5-yl)-ethoxymethylidene]chromium

carbon monoxide;[(4-chloro-2,3-dihydrofuran-5-yl)-ethoxymethylidene]chromium (PubChem CID 10926242) has the molecular formula C12H9ClCrO7 and a molecular weight of 352.65 g/mol. Its IUPAC name is carbon monoxide;[(4-chloro-2,3-dihydrofuran-5-yl)-ethoxymethylidene]chromium.

Molecular Properties

Compound Namecarbon monoxide;[(4-chloro-2,3-dihydrofuran-5-yl)-ethoxymethylidene]chromium
PubChem CID10926242
Molecular FormulaC12H9ClCrO7
Molecular Weight352.65 g/mol
Exact Mass351.94
IUPAC Namecarbon monoxide;[(4-chloro-2,3-dihydrofuran-5-yl)-ethoxymethylidene]chromium
SMILESCCOC(=[Cr])C1=C(Cl)CCO1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+]
InChIInChI=1S/C7H9ClO2.5CO.Cr/c1-2-9-5-7-6(8)3-4-10-7;5*1-2;/h2-4H2,1H3;;;;;;
InChIKeyRZPGMNKUCDASJO-UHFFFAOYSA-N
XLogP1.38
TPSA117.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.65
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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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Frequently Asked Questions

What is the IUPAC name of carbon monoxide;[(4-chloro-2,3-dihydrofuran-5-yl)-ethoxymethylidene]chromium?
The IUPAC name of carbon monoxide;[(4-chloro-2,3-dihydrofuran-5-yl)-ethoxymethylidene]chromium (CID 10926242) is carbon monoxide;[(4-chloro-2,3-dihydrofuran-5-yl)-ethoxymethylidene]chromium.
What is the SMILES notation for carbon monoxide;[(4-chloro-2,3-dihydrofuran-5-yl)-ethoxymethylidene]chromium?
The canonical SMILES for carbon monoxide;[(4-chloro-2,3-dihydrofuran-5-yl)-ethoxymethylidene]chromium is CCOC(=[Cr])C1=C(Cl)CCO1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].
What is the InChIKey of carbon monoxide;[(4-chloro-2,3-dihydrofuran-5-yl)-ethoxymethylidene]chromium?
The InChIKey is RZPGMNKUCDASJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9ClO2.5CO.Cr/c1-2-9-5-7-6(8)3-4-10-7;5*1-2;/h2-4H2,1H3;;;;;;.
What are the key properties of carbon monoxide;[(4-chloro-2,3-dihydrofuran-5-yl)-ethoxymethylidene]chromium?
carbon monoxide;[(4-chloro-2,3-dihydrofuran-5-yl)-ethoxymethylidene]chromium has a molecular weight of 352.65 g/mol, XLogP of 1.38, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbon monoxide;[(4-chloro-2,3-dihydrofuran-5-yl)-ethoxymethylidene]chromium is sourced from PubChem (CID 10926242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).