carbon monoxide;[methoxy(thiophen-2-yl)methylidene]molybdenum

C11H6MoO6S — CID 135076435

IUPACcarbon monoxide;[methoxy(thiophen-2-yl)methylidene]molybdenum
SMILESCOC(=[Mo])c1cccs1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+]
InChIInChI=1S/C6H6OS.5CO.Mo/c1-7-5-6-3-2-4-8-6;5*1-2;/h2-4H,1H3;;;;;;
InChIKeyYXBGJOYXMLRGBH-UHFFFAOYSA-N
MW362.17 g/mol
LogP1.23
Rot. Bonds2

About carbon monoxide;[methoxy(thiophen-2-yl)methylidene]molybdenum

carbon monoxide;[methoxy(thiophen-2-yl)methylidene]molybdenum (PubChem CID 135076435) has the molecular formula C11H6MoO6S and a molecular weight of 362.17 g/mol. Its IUPAC name is carbon monoxide;[methoxy(thiophen-2-yl)methylidene]molybdenum.

Molecular Properties

Compound Namecarbon monoxide;[methoxy(thiophen-2-yl)methylidene]molybdenum
PubChem CID135076435
Molecular FormulaC11H6MoO6S
Molecular Weight362.17 g/mol
Exact Mass363.89
IUPAC Namecarbon monoxide;[methoxy(thiophen-2-yl)methylidene]molybdenum
SMILESCOC(=[Mo])c1cccs1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+]
InChIInChI=1S/C6H6OS.5CO.Mo/c1-7-5-6-3-2-4-8-6;5*1-2;/h2-4H,1H3;;;;;;
InChIKeyYXBGJOYXMLRGBH-UHFFFAOYSA-N
XLogP1.23
TPSA108.73 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.17
LogP ≤ 51.23
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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Related Compounds

methyl 2-oxo-2-thiophen-2-ylacetate
CID 11217486
2-(1,2,2-trithiophen-2-ylethenyl)thiophene
CID 15249530
2-[(E)-3,3,3-trifluoro-1-methoxyprop-1-enyl]thiophene
CID 10679856
methyl (E)-4-oxo-4-thiophen-2-ylbut-2-enoate
CID 12533385
1-thiophen-2-ylpentane-1,4-dione
CID 2741853
2-(1-thiophen-2-ylprop-1-enyl)thiophene
CID 154192160
methyl 2-(thiophene-2-carbonylamino)propanoate
CID 531387
1-thiophen-2-ylprop-1-en-1-ol
CID 68622229
2-(2-methoxyethoxy)ethyl thiophene-2-carboxylate
CID 174814348
methylcarbamoyl thiophene-2-carboxylate
CID 143396062
4-methoxy-1-thiophen-2-ylpentan-1-one
CID 105081586
4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1-thiophen-2-ylbutan-1-one
CID 104563857

Frequently Asked Questions

What is the IUPAC name of carbon monoxide;[methoxy(thiophen-2-yl)methylidene]molybdenum?
The IUPAC name of carbon monoxide;[methoxy(thiophen-2-yl)methylidene]molybdenum (CID 135076435) is carbon monoxide;[methoxy(thiophen-2-yl)methylidene]molybdenum.
What is the SMILES notation for carbon monoxide;[methoxy(thiophen-2-yl)methylidene]molybdenum?
The canonical SMILES for carbon monoxide;[methoxy(thiophen-2-yl)methylidene]molybdenum is COC(=[Mo])c1cccs1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].
What is the InChIKey of carbon monoxide;[methoxy(thiophen-2-yl)methylidene]molybdenum?
The InChIKey is YXBGJOYXMLRGBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6OS.5CO.Mo/c1-7-5-6-3-2-4-8-6;5*1-2;/h2-4H,1H3;;;;;;.
What are the key properties of carbon monoxide;[methoxy(thiophen-2-yl)methylidene]molybdenum?
carbon monoxide;[methoxy(thiophen-2-yl)methylidene]molybdenum has a molecular weight of 362.17 g/mol, XLogP of 1.23, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for carbon monoxide;[methoxy(thiophen-2-yl)methylidene]molybdenum is sourced from PubChem (CID 135076435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).