(E)-7-iodohept-4-en-1-ol

C7H13IO — CID 6376837

IUPAC(E)-7-iodohept-4-en-1-ol
SMILESOCCC/C=C/CCI
InChIInChI=1S/C7H13IO/c8-6-4-2-1-3-5-7-9/h1-2,9H,3-7H2/b2-1+
InChIKeyUICVZWISNDVZGE-OWOJBTEDSA-N
MW240.08 g/mol
LogP2.14
Rot. Bonds5

About (E)-7-iodohept-4-en-1-ol

(E)-7-iodohept-4-en-1-ol (PubChem CID 6376837) has the molecular formula C7H13IO and a molecular weight of 240.08 g/mol. Its IUPAC name is (E)-7-iodohept-4-en-1-ol.

Molecular Properties

Compound Name(E)-7-iodohept-4-en-1-ol
PubChem CID6376837
Molecular FormulaC7H13IO
Molecular Weight240.08 g/mol
Exact Mass240.00
IUPAC Name(E)-7-iodohept-4-en-1-ol
SMILESOCCC/C=C/CCI
InChIInChI=1S/C7H13IO/c8-6-4-2-1-3-5-7-9/h1-2,9H,3-7H2/b2-1+
InChIKeyUICVZWISNDVZGE-OWOJBTEDSA-N
XLogP2.14
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.08
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-7-iodohept-4-en-1-ol?
The IUPAC name of (E)-7-iodohept-4-en-1-ol (CID 6376837) is (E)-7-iodohept-4-en-1-ol.
What is the SMILES notation for (E)-7-iodohept-4-en-1-ol?
The canonical SMILES for (E)-7-iodohept-4-en-1-ol is OCCC/C=C/CCI.
What is the InChIKey of (E)-7-iodohept-4-en-1-ol?
The InChIKey is UICVZWISNDVZGE-OWOJBTEDSA-N. The full InChI is InChI=1S/C7H13IO/c8-6-4-2-1-3-5-7-9/h1-2,9H,3-7H2/b2-1+.
What are the key properties of (E)-7-iodohept-4-en-1-ol?
(E)-7-iodohept-4-en-1-ol has a molecular weight of 240.08 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-7-iodohept-4-en-1-ol is sourced from PubChem (CID 6376837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).