cobalt(2+);prop-2-enoate

C3H3CoO2+ — CID 22476955

IUPACcobalt(2+);prop-2-enoate
SMILESC=CC(=O)[O-].[Co+2]
InChIInChI=1S/C3H4O2.Co/c1-2-3(4)5;/h2H,1H2,(H,4,5);/q;+2/p-1
InChIKeyMRICJQBEKKLIEU-UHFFFAOYSA-M
MW129.99 g/mol
LogP-1.08
Rot. Bonds1

About cobalt(2+);prop-2-enoate

cobalt(2+);prop-2-enoate (PubChem CID 22476955) has the molecular formula C3H3CoO2+ and a molecular weight of 129.99 g/mol. Its IUPAC name is cobalt(2+);prop-2-enoate.

Molecular Properties

Compound Namecobalt(2+);prop-2-enoate
PubChem CID22476955
Molecular FormulaC3H3CoO2+
Molecular Weight129.99 g/mol
Exact Mass129.95
IUPAC Namecobalt(2+);prop-2-enoate
SMILESC=CC(=O)[O-].[Co+2]
InChIInChI=1S/C3H4O2.Co/c1-2-3(4)5;/h2H,1H2,(H,4,5);/q;+2/p-1
InChIKeyMRICJQBEKKLIEU-UHFFFAOYSA-M
XLogP-1.08
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.99
LogP ≤ 5-1.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

lithium;cobalt(2+);hydride;bis(prop-2-enoate)
CID 173125641
prop-2-enoate;tin(4+)
CID 22321076
europium(2+);bis(prop-2-enoate)
CID 19816716
barium(2+);lead(2+);tetrakis(prop-2-enoate)
CID 159431498
aluminum;bis(prop-2-enoate);chloride
CID 175698276
prop-2-enoate sulfate
CID 18971000
lithium;prop-2-enoate;prop-2-enoic acid
CID 90256429
disodium;bis(prop-2-enamide);bis(prop-2-enoate)
CID 173417744
methane;tetrakis(prop-2-enoate);tetrakis(tetramethylazanium)
CID 158693664
CID 18513305
CID 18513305
copper;2-azanidylethylazanide;bis(prop-2-enoate)
CID 131844736
magnesium;2-chloroacetate;prop-2-enoate
CID 22987449

Frequently Asked Questions

What is the IUPAC name of cobalt(2+);prop-2-enoate?
The IUPAC name of cobalt(2+);prop-2-enoate (CID 22476955) is cobalt(2+);prop-2-enoate.
What is the SMILES notation for cobalt(2+);prop-2-enoate?
The canonical SMILES for cobalt(2+);prop-2-enoate is C=CC(=O)[O-].[Co+2].
What is the InChIKey of cobalt(2+);prop-2-enoate?
The InChIKey is MRICJQBEKKLIEU-UHFFFAOYSA-M. The full InChI is InChI=1S/C3H4O2.Co/c1-2-3(4)5;/h2H,1H2,(H,4,5);/q;+2/p-1.
What are the key properties of cobalt(2+);prop-2-enoate?
cobalt(2+);prop-2-enoate has a molecular weight of 129.99 g/mol, XLogP of -1.08, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt(2+);prop-2-enoate is sourced from PubChem (CID 22476955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).