cobalt(2+);methyl(phenoxy)phosphinate

C14H16CoO6P2 — CID 140813109

IUPACcobalt(2+);methyl(phenoxy)phosphinate
SMILESCP(=O)([O-])Oc1ccccc1.CP(=O)([O-])Oc1ccccc1.[Co+2]
InChIInChI=1S/2C7H9O3P.Co/c2*1-11(8,9)10-7-5-3-2-4-6-7;/h2*2-6H,1H3,(H,8,9);/q;;+2/p-2
InChIKeyGLXZIKIUWZAYHJ-UHFFFAOYSA-L
MW401.16 g/mol
LogP2.49
Rot. Bonds4

About cobalt(2+);methyl(phenoxy)phosphinate

cobalt(2+);methyl(phenoxy)phosphinate (PubChem CID 140813109) has the molecular formula C14H16CoO6P2 and a molecular weight of 401.16 g/mol. Its IUPAC name is cobalt(2+);methyl(phenoxy)phosphinate.

Molecular Properties

Compound Namecobalt(2+);methyl(phenoxy)phosphinate
PubChem CID140813109
Molecular FormulaC14H16CoO6P2
Molecular Weight401.16 g/mol
Exact Mass400.98
IUPAC Namecobalt(2+);methyl(phenoxy)phosphinate
SMILESCP(=O)([O-])Oc1ccccc1.CP(=O)([O-])Oc1ccccc1.[Co+2]
InChIInChI=1S/2C7H9O3P.Co/c2*1-11(8,9)10-7-5-3-2-4-6-7;/h2*2-6H,1H3,(H,8,9);/q;;+2/p-2
InChIKeyGLXZIKIUWZAYHJ-UHFFFAOYSA-L
XLogP2.49
TPSA98.72 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.16
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

disodium;phenyl phosphate
CID 2724225
tetrasodium phenyl phosphate
CID 172856118
potassium diphenyl phosphate
CID 23671717
cesium diphenyl phosphate
CID 23664598
(4-tert-butylphenoxy)-methylphosphinate
CID 2313159
chloro(phenoxy)phosphinate
CID 71354399
[amino(methyl)phosphoryl]oxybenzene
CID 11864135
zinc ethyl(phenoxy)phosphinate
CID 118975861
[methyl-[[methyl(phenoxy)phosphoryl]amino]phosphoryl]oxybenzene
CID 11865181
cesium phenyl hydrogen phosphate
CID 175568082
[methoxy(methyl)phosphoryl]oxybenzene
CID 564592
N-methyl-N-[methyl(phenoxy)phosphoryl]methanamine
CID 102289080

Frequently Asked Questions

What is the IUPAC name of cobalt(2+);methyl(phenoxy)phosphinate?
The IUPAC name of cobalt(2+);methyl(phenoxy)phosphinate (CID 140813109) is cobalt(2+);methyl(phenoxy)phosphinate.
What is the SMILES notation for cobalt(2+);methyl(phenoxy)phosphinate?
The canonical SMILES for cobalt(2+);methyl(phenoxy)phosphinate is CP(=O)([O-])Oc1ccccc1.CP(=O)([O-])Oc1ccccc1.[Co+2].
What is the InChIKey of cobalt(2+);methyl(phenoxy)phosphinate?
The InChIKey is GLXZIKIUWZAYHJ-UHFFFAOYSA-L. The full InChI is InChI=1S/2C7H9O3P.Co/c2*1-11(8,9)10-7-5-3-2-4-6-7;/h2*2-6H,1H3,(H,8,9);/q;;+2/p-2.
What are the key properties of cobalt(2+);methyl(phenoxy)phosphinate?
cobalt(2+);methyl(phenoxy)phosphinate has a molecular weight of 401.16 g/mol, XLogP of 2.49, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt(2+);methyl(phenoxy)phosphinate is sourced from PubChem (CID 140813109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).