(E)-1-iodotetradec-1-ene

C14H27I — CID 11359152

IUPAC(E)-1-iodotetradec-1-ene
SMILESCCCCCCCCCCCC/C=C/I
InChIInChI=1S/C14H27I/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h13-14H,2-12H2,1H3/b14-13+
InChIKeyQILKOUAIVQIDOU-BUHFOSPRSA-N
MW322.27 g/mol
LogP6.25
Rot. Bonds11

About (E)-1-iodotetradec-1-ene

(E)-1-iodotetradec-1-ene (PubChem CID 11359152) has the molecular formula C14H27I and a molecular weight of 322.27 g/mol. Its IUPAC name is (E)-1-iodotetradec-1-ene.

Molecular Properties

Compound Name(E)-1-iodotetradec-1-ene
PubChem CID11359152
Molecular FormulaC14H27I
Molecular Weight322.27 g/mol
Exact Mass322.12
IUPAC Name(E)-1-iodotetradec-1-ene
SMILESCCCCCCCCCCCC/C=C/I
InChIInChI=1S/C14H27I/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h13-14H,2-12H2,1H3/b14-13+
InChIKeyQILKOUAIVQIDOU-BUHFOSPRSA-N
XLogP6.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.27
LogP ≤ 56.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-iodooctadec-1-ene
CID 91510729
(E)-1-iodopentadec-1-ene
CID 13225447
(E)-1-iodooct-1-ene;2,2,3,3-tetramethylbutane
CID 54319462
nonacos-7-ene
CID 71381021
(Z)-triacont-9-ene
CID 57484178
hexacont-21-ene
CID 54293076
pentacos-9-ene
CID 25201650
(Z)-heptadec-8-ene
CID 5352243
(Z)-docos-9-ene
CID 11690102
(E)-hexadec-6-ene
CID 5352260
(E)-hexacos-10-ene
CID 22172169
(E)-nonacos-10-ene
CID 14367300

Frequently Asked Questions

What is the IUPAC name of (E)-1-iodotetradec-1-ene?
The IUPAC name of (E)-1-iodotetradec-1-ene (CID 11359152) is (E)-1-iodotetradec-1-ene.
What is the SMILES notation for (E)-1-iodotetradec-1-ene?
The canonical SMILES for (E)-1-iodotetradec-1-ene is CCCCCCCCCCCC/C=C/I.
What is the InChIKey of (E)-1-iodotetradec-1-ene?
The InChIKey is QILKOUAIVQIDOU-BUHFOSPRSA-N. The full InChI is InChI=1S/C14H27I/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15/h13-14H,2-12H2,1H3/b14-13+.
What are the key properties of (E)-1-iodotetradec-1-ene?
(E)-1-iodotetradec-1-ene has a molecular weight of 322.27 g/mol, XLogP of 6.25, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-iodotetradec-1-ene is sourced from PubChem (CID 11359152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).