(E)-tetradec-8-enoic acid

C14H26O2 — CID 22590166

IUPAC(E)-tetradec-8-enoic acid
SMILESCCCCC/C=C/CCCCCCC(=O)O
InChIInChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h6-7H,2-5,8-13H2,1H3,(H,15,16)/b7-6+
InChIKeyTXLBQXBKSSATFT-VOTSOKGWSA-N
MW226.36 g/mol
LogP4.55
Rot. Bonds11

About (E)-tetradec-8-enoic acid

(E)-tetradec-8-enoic acid (PubChem CID 22590166) has the molecular formula C14H26O2 and a molecular weight of 226.36 g/mol. Its IUPAC name is (E)-tetradec-8-enoic acid.

Molecular Properties

Compound Name(E)-tetradec-8-enoic acid
PubChem CID22590166
Molecular FormulaC14H26O2
Molecular Weight226.36 g/mol
Exact Mass226.19
IUPAC Name(E)-tetradec-8-enoic acid
SMILESCCCCC/C=C/CCCCCCC(=O)O
InChIInChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h6-7H,2-5,8-13H2,1H3,(H,15,16)/b7-6+
InChIKeyTXLBQXBKSSATFT-VOTSOKGWSA-N
XLogP4.55
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
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

Oleic Acid
CID 445639
Undecylenic Acid
CID 5634
Linolenic Acid
CID 5280934
Linoleic Acid
CID 5280450
Erucic Acid
CID 5281116
Ricinoleic Acid
CID 643684
Elaidic Acid
CID 637517
Palmitoleic Acid
CID 445638
Gamma-Linolenic acid
CID 5280933
Docosapentaenoic Acid
CID 5497182
Dihomo-Gamma-Linolenic Acid
CID 5280581
Methyl Oleate
CID 5364509

Frequently Asked Questions

What is the IUPAC name of (E)-tetradec-8-enoic acid?
The IUPAC name of (E)-tetradec-8-enoic acid (CID 22590166) is (E)-tetradec-8-enoic acid.
What is the SMILES notation for (E)-tetradec-8-enoic acid?
The canonical SMILES for (E)-tetradec-8-enoic acid is CCCCC/C=C/CCCCCCC(=O)O.
What is the InChIKey of (E)-tetradec-8-enoic acid?
The InChIKey is TXLBQXBKSSATFT-VOTSOKGWSA-N. The full InChI is InChI=1S/C14H26O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14(15)16/h6-7H,2-5,8-13H2,1H3,(H,15,16)/b7-6+.
What are the key properties of (E)-tetradec-8-enoic acid?
(E)-tetradec-8-enoic acid has a molecular weight of 226.36 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 (E)-tetradec-8-enoic acid is sourced from PubChem (CID 22590166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).