erbium;(Z)-tetradec-9-enoic acid

C14H26ErO2 — CID 155169208

IUPACerbium;(Z)-tetradec-9-enoic acid
SMILESCCCC/C=C\CCCCCCCC(=O)O.[Er]
InChIInChI=1S/C14H26O2.Er/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16;/h5-6H,2-4,7-13H2,1H3,(H,15,16);/b6-5-;
InChIKeyFXQVPRLTCJLBFD-YSMBQZINSA-N
MW393.62 g/mol
LogP4.55
Rot. Bonds11

About erbium;(Z)-tetradec-9-enoic acid

erbium;(Z)-tetradec-9-enoic acid (PubChem CID 155169208) has the molecular formula C14H26ErO2 and a molecular weight of 393.62 g/mol. Its IUPAC name is erbium;(Z)-tetradec-9-enoic acid.

Molecular Properties

Compound Nameerbium;(Z)-tetradec-9-enoic acid
PubChem CID155169208
Molecular FormulaC14H26ErO2
Molecular Weight393.62 g/mol
Exact Mass392.12
IUPAC Nameerbium;(Z)-tetradec-9-enoic acid
SMILESCCCC/C=C\CCCCCCCC(=O)O.[Er]
InChIInChI=1S/C14H26O2.Er/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16;/h5-6H,2-4,7-13H2,1H3,(H,15,16);/b6-5-;
InChIKeyFXQVPRLTCJLBFD-YSMBQZINSA-N
XLogP4.55
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.62
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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

(E)-tetradec-9-enoic acid
CID 5312402
(E)-hexadec-11-enoic acid
CID 5312413
(E)-tricos-18-enoic acid
CID 20847589
(E)-nonadec-14-enoic acid
CID 101410255
cadmium;bis((E)-octadec-9-enoic acid)
CID 156767873
iron;(Z)-octadec-13-enoic acid
CID 175306655
praseodymium;(Z)-tetradec-9-enoic acid
CID 155169102
nickel;bis((Z)-tetradec-9-enoic acid)
CID 155704204
lanthanum;tris((Z)-tetradec-9-enoic acid)
CID 155704268
dysprosium;tris((Z)-tetradec-9-enoic acid)
CID 155704207
tetradecanoic acid;tetradec-9-enoic acid
CID 162088286
lithium;hydride;tetradec-9-enoic acid
CID 173353076

Frequently Asked Questions

What is the IUPAC name of erbium;(Z)-tetradec-9-enoic acid?
The IUPAC name of erbium;(Z)-tetradec-9-enoic acid (CID 155169208) is erbium;(Z)-tetradec-9-enoic acid.
What is the SMILES notation for erbium;(Z)-tetradec-9-enoic acid?
The canonical SMILES for erbium;(Z)-tetradec-9-enoic acid is CCCC/C=C\CCCCCCCC(=O)O.[Er].
What is the InChIKey of erbium;(Z)-tetradec-9-enoic acid?
The InChIKey is FXQVPRLTCJLBFD-YSMBQZINSA-N. The full InChI is InChI=1S/C14H26O2.Er/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16;/h5-6H,2-4,7-13H2,1H3,(H,15,16);/b6-5-;.
What are the key properties of erbium;(Z)-tetradec-9-enoic acid?
erbium;(Z)-tetradec-9-enoic acid has a molecular weight of 393.62 g/mol, XLogP of 4.55, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for erbium;(Z)-tetradec-9-enoic acid is sourced from PubChem (CID 155169208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).