cobalt;undec-10-enoate

C11H19CoO2- — CID 160733678

IUPACcobalt;undec-10-enoate
SMILESC=CCCCCCCCCC(=O)[O-].[Co]
InChIInChI=1S/C11H20O2.Co/c1-2-3-4-5-6-7-8-9-10-11(12)13;/h2H,1,3-10H2,(H,12,13);/p-1
InChIKeyVEVCZOXTRLORHS-UHFFFAOYSA-M
MW242.20 g/mol
LogP2.04
Rot. Bonds9

About cobalt;undec-10-enoate

cobalt;undec-10-enoate (PubChem CID 160733678) has the molecular formula C11H19CoO2- and a molecular weight of 242.20 g/mol. Its IUPAC name is cobalt;undec-10-enoate.

Molecular Properties

Compound Namecobalt;undec-10-enoate
PubChem CID160733678
Molecular FormulaC11H19CoO2-
Molecular Weight242.20 g/mol
Exact Mass242.07
IUPAC Namecobalt;undec-10-enoate
SMILESC=CCCCCCCCCC(=O)[O-].[Co]
InChIInChI=1S/C11H20O2.Co/c1-2-3-4-5-6-7-8-9-10-11(12)13;/h2H,1,3-10H2,(H,12,13);/p-1
InChIKeyVEVCZOXTRLORHS-UHFFFAOYSA-M
XLogP2.04
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.20
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

iron(2+);bis(undec-10-enoate)
CID 89315244
calcium undec-10-enoate
CID 23617473
lithium dec-9-enoate
CID 23716774
indium(3+);octadec-1-ene;tris(tetradecanoate)
CID 175277283
diethylalumanylium;undec-10-enoate
CID 21401828
5-[bis(4-carboxybutyl)-tetracos-23-enylazaniumyl]pentanoate
CID 177410740
tricosa-1,22-dien-12-one
CID 86210796
tridecanedioate
CID 6994474
4-[bis(3-carboxypropyl)-nonadec-18-enylazaniumyl]butanoate
CID 177486419
4-[bis(3-carboxypropyl)-tridec-12-enylazaniumyl]butanoate
CID 177447962
nonadec-18-enoic acid
CID 543857
tritriacont-32-enoic acid
CID 54063641

Frequently Asked Questions

What is the IUPAC name of cobalt;undec-10-enoate?
The IUPAC name of cobalt;undec-10-enoate (CID 160733678) is cobalt;undec-10-enoate.
What is the SMILES notation for cobalt;undec-10-enoate?
The canonical SMILES for cobalt;undec-10-enoate is C=CCCCCCCCCC(=O)[O-].[Co].
What is the InChIKey of cobalt;undec-10-enoate?
The InChIKey is VEVCZOXTRLORHS-UHFFFAOYSA-M. The full InChI is InChI=1S/C11H20O2.Co/c1-2-3-4-5-6-7-8-9-10-11(12)13;/h2H,1,3-10H2,(H,12,13);/p-1.
What are the key properties of cobalt;undec-10-enoate?
cobalt;undec-10-enoate has a molecular weight of 242.20 g/mol, XLogP of 2.04, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cobalt;undec-10-enoate is sourced from PubChem (CID 160733678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).